CARBAZOCHROME, (R)-

Stereochemistry	ABSOLUTE
Molecular Formula	C10H12N4O3
Molecular Weight	236.2273
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	1
Charge	0
Stereo Comments	Assumed Z-isomer. MM2 minimum energy for Z and E isomers were 1.6839 and 6.8778 kcal/mol respectively.

CN1C[C@H](O)C2=C\C(=N\NC(N)=O)C(=O)C=C12

InChIKey=XSXCZNVKFKNLPR-TXEUWIOXSA-N

InChI=1S/C10H12N4O3/c1-14-4-9(16)5-2-6(12-13-10(11)17)8(15)3-7(5)14/h2-3,9,16H,4H2,1H3,(H3,11,13,17)/b12-6-/t9-/m0/s1

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

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:12:10 UTC 2023` Edited by `admin` on `Sat Dec 16 10:12:10 UTC 2023`
Record UNII	2P2825ZN5Z
Record Status	`Validated (UNII)`
Record Version

Name

Type

Language

CARBAZOCHROME, (R)-

Common Name

English

HYDRAZINECARBOXAMIDE, 2-((3R)-1,2,3,6-TETRAHYDRO-3-HYDROXY-1-METHYL-6-OXO-5H-INDOL-5-YLIDENE)-

Systematic Name

English

Code System Code Type Description

CAS

329329-69-3

Created by admin on Sat Dec 16 10:12:10 UTC 2023 , Edited by admin on Sat Dec 16 10:12:10 UTC 2023

PRIMARY

PUBCHEM

51404401

Created by admin on Sat Dec 16 10:12:10 UTC 2023 , Edited by admin on Sat Dec 16 10:12:10 UTC 2023

PRIMARY

EPA CompTox

DTXSID30873062

Created by admin on Sat Dec 16 10:12:10 UTC 2023 , Edited by admin on Sat Dec 16 10:12:10 UTC 2023

PRIMARY

FDA UNII

2P2825ZN5Z

Created by admin on Sat Dec 16 10:12:10 UTC 2023 , Edited by admin on Sat Dec 16 10:12:10 UTC 2023

PRIMARY

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