[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-(3-methylphenyl)methanone

Systemtic Name: [4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-(3-methylphenyl)methanone Openeye Name: [4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]-(m-tolyl)methanone CAS Name: [4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-(3-methylphenyl)methanone IUPAC Name: [4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-(3-methylphenyl)methanone Traditional Name: [4-(4-chloro-2-nitro-phenyl)piperazino]-(m-tolyl)methanone Formula: C18H18ClN3O3 MolecularWeight: 359.80682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H18ClN3O3/c1-13-3-2-4-14(11-13)18(23)21-9-7-20(8-10-21)16-6-5-15(19)12-17(16)22(24)25/h2-6,11-12H,7-10H2,1H3