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

Systemtic Name: (3-bromophenyl)-[4-(2-methylphenyl)piperazin-1-yl]methanone Openeye Name: (3-bromophenyl)-[4-(o-tolyl)piperazin-1-yl]methanone CAS Name: (3-bromophenyl)-[4-(2-methylphenyl)-1-piperazinyl]methanone IUPAC Name: (3-bromophenyl)-[4-(2-methylphenyl)piperazin-1-yl]methanone Traditional Name: (3-bromophenyl)-[4-(o-tolyl)piperazino]methanone Formula: C18H19BrN2O MolecularWeight: 359.26026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C18H19BrN2O/c1-14-5-2-3-8-17(14)20-9-11-21(12-10-20)18(22)15-6-4-7-16(19)13-15/h2-8,13H,9-12H2,1H3