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

Systemtic Name: [4-[4-nitro-3-[phenyl-(phenylmethyl)amino]phenyl]piperazin-1-yl]-phenyl-methanone Openeye Name: [4-[3-(N-benzylanilino)-4-nitro-phenyl]piperazin-1-yl]-phenyl-methanone CAS Name: [4-[4-nitro-3-(N-(phenylmethyl)anilino)phenyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [4-[3-(N-benzylanilino)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone Traditional Name: [4-[3-(N-benzylanilino)-4-nitro-phenyl]piperazino]-phenyl-methanone Formula: C30H28N4O3 MolecularWeight: 492.56832

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])N(CC3=CC=CC=C3)C4=CC=CC=C4)C(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])N(CC3=CC=CC=C3)C4=CC=CC=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C30H28N4O3/c35-30(25-12-6-2-7-13-25)32-20-18-31(19-21-32)27-16-17-28(34(36)37)29(22-27)33(26-14-8-3-9-15-26)23-24-10-4-1-5-11-24/h1-17,22H,18-21,23H2