1H-Indole-6-carboxylic acid, 2,3-dihydro-3-[[[4-[methyl[2-(4-methyl-4-oxido-1-piperazinyl)acetyl]amino]phenyl]amino]phenylmethylene]-2-oxo-, methyl ester, (3Z)-

Details

Stereochemistry	ACHIRAL
Molecular Formula	C31H33N5O5
Molecular Weight	555.6242
Optical Activity	NONE
Defined Stereocenters	0 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 1H-Indole-6-carboxylic acid, 2,3-dihydro-3-[[[4-[methyl[2-(4-methyl-4-oxido-1-piperazinyl)acetyl]amino]phenyl]amino]phenylmethylene]-2-oxo-, methyl ester, (3Z)-

Structure Search

SMILES

COC(=O)C1=CC2=C(C=C1)\C(C(=O)N2)=C(\NC3=CC=C(C=C3)N(C)C(=O)CN4CC[N+](C)([O-])CC4)C5=CC=CC=C5

InChI

InChIKey=YUQGGFXCZXHSKQ-ZIADKAODSA-N

InChI=1S/C31H33N5O5/c1-34(27(37)20-35-15-17-36(2,40)18-16-35)24-12-10-23(11-13-24)32-29(21-7-5-4-6-8-21)28-25-14-9-22(31(39)41-3)19-26(25)33-30(28)38/h4-14,19,32H,15-18,20H2,1-3H3,(H,33,38)/b29-28-

HIDE SMILES / InChI

Molecular Formula	C31H33N5O5
Molecular Weight	555.6242
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 12:08:03 GMT 2025` Edited by `admin` on `Wed Apr 02 12:08:03 GMT 2025`
Record UNII	F2KCD2JLC8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1H-Indole-6-carboxylic acid, 2,3-dihydro-3-[[[4-[methyl[2-(4-methyl-4-oxido-1-piperazinyl)acetyl]amino]phenyl]amino]phenylmethylene]-2-oxo-, methyl ester, (3Z)-

Preferred Name

English

Code System Code Type Description

FDA UNII

F2KCD2JLC8

Created by admin on Wed Apr 02 12:08:03 GMT 2025 , Edited by admin on Wed Apr 02 12:08:03 GMT 2025

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CAS

3029792-02-4

Created by admin on Wed Apr 02 12:08:03 GMT 2025 , Edited by admin on Wed Apr 02 12:08:03 GMT 2025

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