(4-chlorophenyl)-[5-nitro-2-[4-(phenylmethyl)piperazin-1-yl]phenyl]methanone

Systemtic Name: (4-chlorophenyl)-[5-nitro-2-[4-(phenylmethyl)piperazin-1-yl]phenyl]methanone Openeye Name: [2-(4-benzylpiperazin-1-yl)-5-nitro-phenyl]-(4-chlorophenyl)methanone CAS Name: (4-chlorophenyl)-[5-nitro-2-[4-(phenylmethyl)-1-piperazinyl]phenyl]methanone IUPAC Name: [2-(4-benzylpiperazin-1-yl)-5-nitrophenyl]-(4-chlorophenyl)methanone Traditional Name: [2-(4-benzylpiperazino)-5-nitro-phenyl]-(4-chlorophenyl)methanone Formula: C24H22ClN3O3 MolecularWeight: 435.90278

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H22ClN3O3/c25-20-8-6-19(7-9-20)24(29)22-16-21(28(30)31)10-11-23(22)27-14-12-26(13-15-27)17-18-4-2-1-3-5-18/h1-11,16H,12-15,17H2