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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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