3-[(2-nitrophenyl)amino]-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]propanamide

Systemtic Name: 3-[(2-nitrophenyl)amino]-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]propanamide Openeye Name: 3-(2-nitroanilino)-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]propanamide CAS Name: 3-(2-nitroanilino)-N-[[4-(3-oxo-1-piperazinyl)phenyl]methyl]propanamide IUPAC Name: 3-(2-nitroanilino)-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]propanamide Traditional Name: N-[4-(3-ketopiperazino)benzyl]-3-(2-nitroanilino)propionamide Formula: C20H23N5O4 MolecularWeight: 397.42772

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=CC=C(C=C2)CNC(=O)CCNC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CN(CC(=O)N1)C2=CC=C(C=C2)CNC(=O)CCNC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H23N5O4/c26-19(9-10-21-17-3-1-2-4-18(17)25(28)29)23-13-15-5-7-16(8-6-15)24-12-11-22-20(27)14-24/h1-8,21H,9-14H2,(H,22,27)(H,23,26)