4-[4-(diphenylmethyl)piperazin-1-yl]-3-nitro-benzamide

Systemtic Name: 4-[4-(diphenylmethyl)piperazin-1-yl]-3-nitro-benzamide Openeye Name: 4-(4-benzhydrylpiperazin-1-yl)-3-nitro-benzamide CAS Name: 4-[4-(diphenylmethyl)-1-piperazinyl]-3-nitrobenzamide IUPAC Name: 4-(4-benzhydrylpiperazin-1-yl)-3-nitrobenzamide Traditional Name: 4-(4-benzhydrylpiperazino)-3-nitro-benzamide Formula: C24H24N4O3 MolecularWeight: 416.47236

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H24N4O3/c25-24(29)20-11-12-21(22(17-20)28(30)31)26-13-15-27(16-14-26)23(18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-12,17,23H,13-16H2,(H2,25,29)