N-[3-azanyl-1-[3-nitro-4-(4-phenylpiperazin-1-yl)phenyl]-3-oxidanylidene-propyl]benzamide

Systemtic Name: N-[3-azanyl-1-[3-nitro-4-(4-phenylpiperazin-1-yl)phenyl]-3-oxidanylidene-propyl]benzamide Openeye Name: N-[3-amino-1-[3-nitro-4-(4-phenylpiperazin-1-yl)phenyl]-3-oxo-propyl]benzamide CAS Name: N-[3-amino-1-[3-nitro-4-(4-phenyl-1-piperazinyl)phenyl]-3-oxopropyl]benzamide IUPAC Name: N-[3-amino-1-[3-nitro-4-(4-phenylpiperazin-1-yl)phenyl]-3-oxopropyl]benzamide Traditional Name: N-[3-amino-3-keto-1-[3-nitro-4-(4-phenylpiperazino)phenyl]propyl]benzamide Formula: C26H27N5O4 MolecularWeight: 473.52368

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=C(C=C(C=C3)C(CC(=O)N)NC(=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=C(C=C(C=C3)C(CC(=O)N)NC(=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H27N5O4/c27-25(32)18-22(28-26(33)19-7-3-1-4-8-19)20-11-12-23(24(17-20)31(34)35)30-15-13-29(14-16-30)21-9-5-2-6-10-21/h1-12,17,22H,13-16,18H2,(H2,27,32)(H,28,33)