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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1CN(CCN1C2=CC(=C(C=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)27-15-13-26(14-16-27)21-11-12-23(28(30)31)22(17-21)25-18-19-7-3-1-4-8-19/h1-12,17,25H,13-16,18H2