Palonidipine hydrochloride

Details

Stereochemistry	RACEMIC
Molecular Formula	C29H34FN3O6.ClH
Molecular Weight	576.056
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.COC(=O)C1=C(C)NC(C)=C(C1C2=CC(=CC=C2F)[N+]([O-])=O)C(=O)OCC(C)(C)CN(C)CC3=CC=CC=C3

InChI

InChIKey=OQHXRVQARZHYGQ-UHFFFAOYSA-N

InChI=1S/C29H34FN3O6.ClH/c1-18-24(27(34)38-6)26(22-14-21(33(36)37)12-13-23(22)30)25(19(2)31-18)28(35)39-17-29(3,4)16-32(5)15-20-10-8-7-9-11-20;/h7-14,26,31H,15-17H2,1-6H3;1H

HIDE SMILES / InChI

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

Molecular Formula	C29H34FN3O6
Molecular Weight	539.5952
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:53:34 UTC 2023` Edited by `admin` on `Sat Dec 16 08:53:34 UTC 2023`
Record UNII	9D73PQ95UJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Palonidipine hydrochloride

Common Name

English

3,5-Pyridinedicarboxylic acid, 4-(2-fluoro-5-nitrophenyl)-1,4-dihydro-2,6-dimethyl-, 3-[2,2-dimethyl-3-[methyl(phenylmethyl)amino]propyl] 5-methyl ester, hydrochloride (1:1)

Systematic Name

English

TC-81

Code

English

3,5-Pyridinedicarboxylic acid, 4-(2-fluoro-5-nitrophenyl)-1,4-dihydro-2,6-dimethyl-, 2,2-dimethyl-3-[methyl(phenylmethyl)amino]propyl methyl ester, monohydrochloride

Systematic Name

English

Code System Code Type Description

CAS

96515-74-1

Created by admin on Sat Dec 16 08:53:34 UTC 2023 , Edited by admin on Sat Dec 16 08:53:34 UTC 2023

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EPA CompTox

DTXSID5021099

Created by admin on Sat Dec 16 08:53:34 UTC 2023 , Edited by admin on Sat Dec 16 08:53:34 UTC 2023

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FDA UNII

9D73PQ95UJ

Created by admin on Sat Dec 16 08:53:34 UTC 2023 , Edited by admin on Sat Dec 16 08:53:34 UTC 2023

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PUBCHEM

119153

Created by admin on Sat Dec 16 08:53:34 UTC 2023 , Edited by admin on Sat Dec 16 08:53:34 UTC 2023

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