N-(4-chlorophenyl)-3-nitro-4-[4-(phenylmethyl)piperazin-1-yl]benzamide

Systemtic Name: N-(4-chlorophenyl)-3-nitro-4-[4-(phenylmethyl)piperazin-1-yl]benzamide Openeye Name: 4-(4-benzylpiperazin-1-yl)-N-(4-chlorophenyl)-3-nitro-benzamide CAS Name: N-(4-chlorophenyl)-3-nitro-4-[4-(phenylmethyl)-1-piperazinyl]benzamide IUPAC Name: 4-(4-benzylpiperazin-1-yl)-N-(4-chlorophenyl)-3-nitrobenzamide Traditional Name: 4-(4-benzylpiperazino)-N-(4-chlorophenyl)-3-nitro-benzamide Formula: C24H23ClN4O3 MolecularWeight: 450.91742

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=C(C=C(C=C3)C(=O)NC4=CC=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=C(C=C(C=C3)C(=O)NC4=CC=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C24H23ClN4O3/c25-20-7-9-21(10-8-20)26-24(30)19-6-11-22(23(16-19)29(31)32)28-14-12-27(13-15-28)17-18-4-2-1-3-5-18/h1-11,16H,12-15,17H2,(H,26,30)