DB-51630

Details

Stereochemistry	ACHIRAL
Molecular Formula	C35H24N6O9.ClH
Molecular Weight	709.061
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.[O-][N+](=O)C1=CC2=CC=CC3=C2C(=C1)C(=O)N(CCNCCNC(=O)C4=CC=CC(=C4)N5C(=O)C6=CC(=CC7=CC=CC(C5=O)=C67)[N+]([O-])=O)C3=O

InChI

InChIKey=RYMZEXHPLHMJFZ-UHFFFAOYSA-N

InChI=1S/C35H24N6O9.ClH/c42-31(37-11-10-36-12-13-38-32(43)25-8-2-4-19-14-23(40(47)48)17-27(29(19)25)33(38)44)21-6-1-7-22(16-21)39-34(45)26-9-3-5-20-15-24(41(49)50)18-28(30(20)26)35(39)46;/h1-9,14-18,36H,10-13H2,(H,37,42);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	C35H24N6O9
Molecular Weight	672.5999
Charge	0
Count

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

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:00:28 GMT 2023` Edited by `admin` on `Sat Dec 16 08:00:28 GMT 2023`
Record UNII	L85NJD7H9E
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DB-51630

Common Name

English

BENZAMIDE, 3-(5-NITRO-1,3-DIOXO-1H-BENZ(DE)ISOQUINOLIN-2(3H)-YL)-N-(2-((2-(5-NITRO-1,3-DIOXO-1H-BENZ(DE)ISOQUINOLIN-2(3H)-YL)ETHYL)AMINO)ETHYL)-, MONOHYDROCHLORIDE

Systematic Name

English

BENZAMIDE, 3-(5-NITRO-1,3-DIOXO-1H-BENZ(DE)ISOQUINOLIN-2(3H)-YL)-N-(2-((2-(5-NITRO-1,3-DIOXO-1H-BENZ(DE)ISOQUINOLIN-2(3H)-YL)ETHYL)AMINO)ETHYL)-, HYDROCHLORIDE (1:1)

Systematic Name

English

Code System Code Type Description

FDA UNII

L85NJD7H9E

Created by admin on Sat Dec 16 08:00:28 GMT 2023 , Edited by admin on Sat Dec 16 08:00:28 GMT 2023

PRIMARY

PUBCHEM

11542163

Created by admin on Sat Dec 16 08:00:28 GMT 2023 , Edited by admin on Sat Dec 16 08:00:28 GMT 2023

PRIMARY

CAS

254452-11-4

Created by admin on Sat Dec 16 08:00:28 GMT 2023 , Edited by admin on Sat Dec 16 08:00:28 GMT 2023

PRIMARY

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