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Details

Stereochemistry ACHIRAL
Molecular Formula C27H30N6O4
Molecular Weight 502.5649
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N,N'-Bis(2-methyl-7-nitro-4-quinolyl)heptane-1,7-diamine

SMILES

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

InChI

InChIKey=SERWLEHIUCZSFH-UHFFFAOYSA-N
InChI=1S/C27H30N6O4/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)

HIDE SMILES / InChI

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 Wed Apr 02 16:06:16 GMT 2025
Edited
by admin
on Wed Apr 02 16:06:16 GMT 2025
Record UNII
9KHX2A4QS5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N,N'-Bis(2-methyl-7-nitro-4-quinolyl)heptane-1,7-diamine
Systematic Name English
1,7-Heptanediamine, N,N?-bis(2-methyl-7-nitro-4-quinolinyl)-
Preferred Name English
N<sup>1</sup>,N<sup>7</sup>-bis(2-methyl-7-nitroquinolin-4-yl)heptane-1,7-diamine
Systematic Name English
Code System Code Type Description
PUBCHEM
152086
Created by admin on Wed Apr 02 16:06:16 GMT 2025 , Edited by admin on Wed Apr 02 16:06:16 GMT 2025
PRIMARY
FDA UNII
9KHX2A4QS5
Created by admin on Wed Apr 02 16:06:16 GMT 2025 , Edited by admin on Wed Apr 02 16:06:16 GMT 2025
PRIMARY
CAS
75919-75-4
Created by admin on Wed Apr 02 16:06:16 GMT 2025 , Edited by admin on Wed Apr 02 16:06:16 GMT 2025
PRIMARY
Related Record Type Details
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