(2-methylphenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: (2-methylphenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: [4-(4-nitrophenyl)piperazin-1-yl]-(o-tolyl)methanone CAS Name: (2-methylphenyl)-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (2-methylphenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: [4-(4-nitrophenyl)piperazino]-(o-tolyl)methanone Formula: C18H19N3O3 MolecularWeight: 325.36176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O3/c1-14-4-2-3-5-17(14)18(22)20-12-10-19(11-13-20)15-6-8-16(9-7-15)21(23)24/h2-9H,10-13H2,1H3