NITRACRINE DIHYDROCHLORIDE MONOHYDRATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C18H20N4O2.2ClH.H2O
Molecular Weight	415.314
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of NITRACRINE DIHYDROCHLORIDE MONOHYDRATE

Structure Search

SMILES

O.Cl.Cl.CN(C)CCCNC1=C2C=CC=CC2=NC3=C1C(=CC=C3)[N+]([O-])=O

InChI

InChIKey=NHZMLGQMVDPHND-UHFFFAOYSA-N

InChI=1S/C18H20N4O2.2ClH.H2O/c1-21(2)12-6-11-19-18-13-7-3-4-8-14(13)20-15-9-5-10-16(17(15)18)22(23)24;;;/h3-5,7-10H,6,11-12H2,1-2H3,(H,19,20);2*1H;1H2

HIDE SMILES / InChI

Molecular Formula	H2O
Molecular Weight	18.0153
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C18H20N4O2
Molecular Weight	324.377
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:11:04 UTC 2023` Edited by `admin` on `Sat Dec 16 11:11:04 UTC 2023`
Record UNII	7G5S4303OI
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NITRACRINE DIHYDROCHLORIDE MONOHYDRATE

Common Name

English

9-(3-((DIMETHYLAMINO)PROPYL)AMINO)-1-NITROACRIDINE DIHYDROCHLORIDE MONOHYDRATE

Systematic Name

English

LEDAKRIN

Brand Name

English

NITRACRINE DIHYDROCHLORIDE MONOHYDRATE [MI]

Common Name

English

1,3-PROPANEDIAMINE, N1,N1-DIMETHYL-N3-(1-NITRO-9-ACRIDINYL)-, HYDROCHLORIDE, HYDRATE (1:2:1)

Systematic Name

English

C-283

Code

English

Code System Code Type Description

CAS

55429-45-3

Created by admin on Sat Dec 16 11:11:04 UTC 2023 , Edited by admin on Sat Dec 16 11:11:04 UTC 2023

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FDA UNII

7G5S4303OI

Created by admin on Sat Dec 16 11:11:04 UTC 2023 , Edited by admin on Sat Dec 16 11:11:04 UTC 2023

PRIMARY

MERCK INDEX

m7927

Created by admin on Sat Dec 16 11:11:04 UTC 2023 , Edited by admin on Sat Dec 16 11:11:04 UTC 2023

PRIMARY

Merck Index

PUBCHEM

72941568

Created by admin on Sat Dec 16 11:11:04 UTC 2023 , Edited by admin on Sat Dec 16 11:11:04 UTC 2023

PRIMARY

Related Record Type Details


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NITRACRINE DIHYDROCHLORIDE

ANHYDROUS->SOLVATE