N1,N7-bis(2-methyl-7-nitroquinolin-4-yl)heptane-1,7-diamine dihydrochloride

Details

Stereochemistry	ACHIRAL
Molecular Formula	C27H30N6O4.2ClH
Molecular Weight	575.487
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N1,N7-bis(2-methyl-7-nitroquinolin-4-yl)heptane-1,7-diamine dihydrochloride

Structure Search

SMILES

Cl.Cl.CC1=CC(NCCCCCCCNC2=C3C=CC(=CC3=NC(C)=C2)[N+]([O-])=O)=C4C=CC(=CC4=N1)[N+]([O-])=O

InChI

InChIKey=XLVGXPALTINKCH-UHFFFAOYSA-N

InChI=1S/C27H30N6O4.2ClH/c1-18-14-24(22-10-8-20(32(34)35)16-26(22)30-18)28-12-6-4-3-5-7-13-29-25-15-19(2)31-27-17-21(33(36)37)9-11-23(25)27;;/h8-11,14-17H,3-7,12-13H2,1-2H3,(H,28,30)(H,29,31);2*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	C27H30N6O4
Molecular Weight	502.5649
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 `Tue Apr 01 19:48:45 GMT 2025` Edited by `admin` on `Tue Apr 01 19:48:45 GMT 2025`
Record UNII	M55ECF4V88
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-272346

Preferred Name

English

N1,N7-bis(2-methyl-7-nitroquinolin-4-yl)heptane-1,7-diamine dihydrochloride

Systematic Name

English

1,7-HEPTANEDIAMINE, N,N'-BIS(2-METHYL-7-NITRO-4-QUINOLINYL)-, DIHYDROCHLORIDE

Common Name

English

Code System Code Type Description

FDA UNII

M55ECF4V88