[4-(2-chloranyl-6-nitro-phenyl)piperazin-1-yl]-(3-methylphenyl)methanone

Systemtic Name: [4-(2-chloranyl-6-nitro-phenyl)piperazin-1-yl]-(3-methylphenyl)methanone Openeye Name: [4-(2-chloro-6-nitro-phenyl)piperazin-1-yl]-(m-tolyl)methanone CAS Name: [4-(2-chloro-6-nitrophenyl)-1-piperazinyl]-(3-methylphenyl)methanone IUPAC Name: [4-(2-chloro-6-nitrophenyl)piperazin-1-yl]-(3-methylphenyl)methanone Traditional Name: [4-(2-chloro-6-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=CC=C3Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)[N+](=O)[O-]

InChI

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