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Details

Stereochemistry ACHIRAL
Molecular Formula C18H18N6O7
Molecular Weight 430.3715
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(4-methylpiperazin-1-yl)-3,5-dinitro-N-(4-nitrophenyl)benzamide

SMILES

CN1CCN(CC1)C2=C(C=C(C=C2[N+]([O-])=O)[N+]([O-])=O)C(=O)NC3=CC=C(C=C3)[N+]([O-])=O

InChI

InChIKey=PZJMORMFMAADRP-UHFFFAOYSA-N
InChI=1S/C18H18N6O7/c1-20-6-8-21(9-7-20)17-15(10-14(23(28)29)11-16(17)24(30)31)18(25)19-12-2-4-13(5-3-12)22(26)27/h2-5,10-11H,6-9H2,1H3,(H,19,25)

HIDE SMILES / InChI

Molecular Formula C18H18N6O7
Molecular Weight 430.3715
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 19:33:44 GMT 2025
Edited
by admin
on Tue Apr 01 19:33:44 GMT 2025
Record UNII
45964UE7RY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(4-methylpiperazin-1-yl)-3,5-dinitro-N-(4-nitrophenyl)benzamide
Systematic Name English
NSC-374414
Preferred Name English
Benzamide, 2-(4-methyl-1-piperazinyl)-3,5-dinitro-N-(4-nitrophenyl)-
Systematic Name English
Code System Code Type Description
CAS
83907-91-9
Created by admin on Tue Apr 01 19:33:44 GMT 2025 , Edited by admin on Tue Apr 01 19:33:44 GMT 2025
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PUBCHEM
341646
Created by admin on Tue Apr 01 19:33:44 GMT 2025 , Edited by admin on Tue Apr 01 19:33:44 GMT 2025
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NSC
374414
Created by admin on Tue Apr 01 19:33:44 GMT 2025 , Edited by admin on Tue Apr 01 19:33:44 GMT 2025
PRIMARY
EPA CompTox
DTXSID60232800
Created by admin on Tue Apr 01 19:33:44 GMT 2025 , Edited by admin on Tue Apr 01 19:33:44 GMT 2025
PRIMARY
FDA UNII
45964UE7RY
Created by admin on Tue Apr 01 19:33:44 GMT 2025 , Edited by admin on Tue Apr 01 19:33:44 GMT 2025
PRIMARY