[5-nitro-2-[(phenylmethyl)amino]phenyl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [5-nitro-2-[(phenylmethyl)amino]phenyl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [2-(benzylamino)-5-nitro-phenyl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [5-nitro-2-[(phenylmethyl)amino]phenyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [2-(benzylamino)-5-nitrophenyl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [2-(benzylamino)-5-nitro-phenyl]-(4-phenylpiperazino)methanone Formula: C24H24N4O3 MolecularWeight: 416.47236

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NCC4=CC=CC=C4

InChI

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