[4-[3-nitro-5-[(phenylmethyl)amino]phenyl]piperazin-1-yl]-phenyl-methanone

Systemtic Name: [4-[3-nitro-5-[(phenylmethyl)amino]phenyl]piperazin-1-yl]-phenyl-methanone Openeye Name: [4-[3-(benzylamino)-5-nitro-phenyl]piperazin-1-yl]-phenyl-methanone CAS Name: [4-[3-nitro-5-[(phenylmethyl)amino]phenyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [4-[3-(benzylamino)-5-nitrophenyl]piperazin-1-yl]-phenylmethanone Traditional Name: [4-[3-(benzylamino)-5-nitro-phenyl]piperazino]-phenyl-methanone Formula: C24H24N4O3 MolecularWeight: 416.47236

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC(=C2)[N+](=O)[O-])NCC3=CC=CC=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC(=CC(=C2)[N+](=O)[O-])NCC3=CC=CC=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H24N4O3/c29-24(20-9-5-2-6-10-20)27-13-11-26(12-14-27)22-15-21(16-23(17-22)28(30)31)25-18-19-7-3-1-4-8-19/h1-10,15-17,25H,11-14,18H2