JCF-177

Details

Stereochemistry	ACHIRAL
Molecular Formula	C18H18N2O2S.C2H2O4
Molecular Weight	416.448
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)C(O)=O.NC1=CC=C(C=C1)S(=O)(=O)N2C3=C(CCCC3)C4=C2C=CC=C4

InChI

InChIKey=VJCINNBTQJWNTP-UHFFFAOYSA-N

InChI=1S/C18H18N2O2S.C2H2O4/c19-13-9-11-14(12-10-13)23(21,22)20-17-7-3-1-5-15(17)16-6-2-4-8-18(16)20;3-1(4)2(5)6/h1,3,5,7,9-12H,2,4,6,8,19H2;(H,3,4)(H,5,6)

HIDE SMILES / InChI

Molecular Formula	C18H18N2O2S
Molecular Weight	326.413
Charge	0
Count

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

Molecular Formula	C2H2O4
Molecular Weight	90.0349
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 `Mon Mar 31 22:50:45 GMT 2025` Edited by `admin` on `Mon Mar 31 22:50:45 GMT 2025`
Record UNII	7886BLY75Z
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

JCF-177

Common Name

English

BENZENAMINE, 4-((1,2,3,4-TETRAHYDRO-9H-CARBAZOL-9-YL)SULFONYL)-, ETHANEDIOATE (1:1)

Preferred Name

English

Code System Code Type Description

PUBCHEM

6918747

Created by admin on Mon Mar 31 22:50:45 GMT 2025 , Edited by admin on Mon Mar 31 22:50:45 GMT 2025

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FDA UNII

7886BLY75Z

Created by admin on Mon Mar 31 22:50:45 GMT 2025 , Edited by admin on Mon Mar 31 22:50:45 GMT 2025

PRIMARY

CAS

1037405-04-1

Created by admin on Mon Mar 31 22:50:45 GMT 2025 , Edited by admin on Mon Mar 31 22:50:45 GMT 2025

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