N-[3-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-3-oxidanylidene-1-phenyl-propyl]benzamide

Systemtic Name: N-[3-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-3-oxidanylidene-1-phenyl-propyl]benzamide Openeye Name: N-[3-[4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]-3-oxo-1-phenyl-propyl]benzamide CAS Name: N-[3-[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-3-oxo-1-phenylpropyl]benzamide IUPAC Name: N-[3-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-3-oxo-1-phenylpropyl]benzamide Traditional Name: N-[3-[4-(4-chloro-2-nitro-phenyl)piperazino]-3-keto-1-phenyl-propyl]benzamide Formula: C26H25ClN4O4 MolecularWeight: 492.9541

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H25ClN4O4/c27-21-11-12-23(24(17-21)31(34)35)29-13-15-30(16-14-29)25(32)18-22(19-7-3-1-4-8-19)28-26(33)20-9-5-2-6-10-20/h1-12,17,22H,13-16,18H2,(H,28,33)