1-[4-[(4-bromophenyl)-phenyl-methyl]-2-propan-2-yl-piperazin-1-yl]-2-cyclohexyl-ethanone

Systemtic Name: 1-[4-[(4-bromophenyl)-phenyl-methyl]-2-propan-2-yl-piperazin-1-yl]-2-cyclohexyl-ethanone Openeye Name: 1-[4-[(4-bromophenyl)-phenyl-methyl]-2-isopropyl-piperazin-1-yl]-2-cyclohexyl-ethanone CAS Name: 1-[4-[(4-bromophenyl)-phenylmethyl]-2-propan-2-yl-1-piperazinyl]-2-cyclohexylethanone IUPAC Name: 1-[4-[(4-bromophenyl)-phenylmethyl]-2-propan-2-ylpiperazin-1-yl]-2-cyclohexylethanone Traditional Name: 1-[4-[(4-bromophenyl)-phenyl-methyl]-2-isopropyl-piperazino]-2-cyclohexyl-ethanone Formula: C28H37BrN2O MolecularWeight: 497.51018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CN(CCN1C(=O)CC2CCCCC2)C(C3=CC=CC=C3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC(C)C1CN(CCN1C(=O)CC2CCCCC2)C(C3=CC=CC=C3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C28H37BrN2O/c1-21(2)26-20-30(17-18-31(26)27(32)19-22-9-5-3-6-10-22)28(23-11-7-4-8-12-23)24-13-15-25(29)16-14-24/h4,7-8,11-16,21-22,26,28H,3,5-6,9-10,17-20H2,1-2H3