N-(3-nitrophenyl)-3-(3-oxidanylidenepiperazin-1-yl)propanamide

Systemtic Name: N-(3-nitrophenyl)-3-(3-oxidanylidenepiperazin-1-yl)propanamide Openeye Name: N-(3-nitrophenyl)-3-(3-oxopiperazin-1-yl)propanamide CAS Name: N-(3-nitrophenyl)-3-(3-oxo-1-piperazinyl)propanamide IUPAC Name: N-(3-nitrophenyl)-3-(3-oxopiperazin-1-yl)propanamide Traditional Name: 3-(3-ketopiperazino)-N-(3-nitrophenyl)propionamide Formula: C13H16N4O4 MolecularWeight: 292.29054

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)CCC(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC(=O)N1)CCC(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H16N4O4/c18-12(4-6-16-7-5-14-13(19)9-16)15-10-2-1-3-11(8-10)17(20)21/h1-3,8H,4-7,9H2,(H,14,19)(H,15,18)