ARIMOCLOMOL MALEATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C14H20ClN3O3.C4H4O4
Molecular Weight	429.852
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)\C=C/C(O)=O.O[C@@H](CON=C(Cl)C1=C[N+]([O-])=CC=C1)CN2CCCCC2

InChI

InChIKey=OHUSJUJCPWMZKR-GARNONDBSA-N

InChI=1S/C14H20ClN3O3.C4H4O4/c15-14(12-5-4-8-18(20)9-12)16-21-11-13(19)10-17-6-2-1-3-7-17;5-3(6)1-2-4(7)8/h4-5,8-9,13,19H,1-3,6-7,10-11H2;1-2H,(H,5,6)(H,7,8)/b16-14-;2-1-/t13-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C4H4O4
Molecular Weight	116.0722
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Molecular Formula	C14H20ClN3O3
Molecular Weight	313.78
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:31:00 UTC 2023` Edited by `admin` on `Sat Dec 16 08:31:00 UTC 2023`
Record UNII	18D1V854HG
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ARIMOCLOMOL MALEATE

Common Name

English

BRX-220

Code

English

3-PYRIDINECARBOXIMIDOYL CHLORIDE, N-((2R)-2-HYDROXY-3-(1-PIPERIDINYL)PROPOXY)-, 1-OXIDE, (2Z)-2-BUTENEDIOATE (1:1)

Systematic Name

English

ARIMOCLOMOL MALEATE [MI]

Common Name

English

3-PYRIDINECARBOXIMIDOYL CHLORIDE, N-((2R)-2-HYDROXY-3-(1-PIPERIDINYL)PROPOXY)-, 1-OXIDE, (2Z)-2-BUTENEDIOATE (1:1) (SALT)

Systematic Name

English

Code System Code Type Description

SMS_ID

100000177258