[2-[[4-[(2-bromophenyl)methyl]piperazin-1-yl]methyl]-3,4-dihydro-2H-quinolin-1-yl]-cyclohexyl-methanone

Systemtic Name: [2-[[4-[(2-bromophenyl)methyl]piperazin-1-yl]methyl]-3,4-dihydro-2H-quinolin-1-yl]-cyclohexyl-methanone Openeye Name: [2-[[4-[(2-bromophenyl)methyl]piperazin-1-yl]methyl]-3,4-dihydro-2H-quinolin-1-yl]-cyclohexyl-methanone CAS Name: [2-[[4-[(2-bromophenyl)methyl]-1-piperazinyl]methyl]-3,4-dihydro-2H-quinolin-1-yl]-cyclohexylmethanone IUPAC Name: [2-[[4-[(2-bromophenyl)methyl]piperazin-1-yl]methyl]-3,4-dihydro-2H-quinolin-1-yl]-cyclohexylmethanone Traditional Name: [2-[[4-(2-bromobenzyl)piperazino]methyl]-3,4-dihydro-2H-quinolin-1-yl]-cyclohexyl-methanone Formula: C28H36BrN3O MolecularWeight: 510.50894

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N2C(CCC3=CC=CC=C32)CN4CCN(CC4)CC5=CC=CC=C5Br

Isomeric SMILES

C1CCC(CC1)C(=O)N2C(CCC3=CC=CC=C32)CN4CCN(CC4)CC5=CC=CC=C5Br

InChI

InChI=1S/C28H36BrN3O/c29-26-12-6-4-11-24(26)20-30-16-18-31(19-17-30)21-25-15-14-22-8-5-7-13-27(22)32(25)28(33)23-9-2-1-3-10-23/h4-8,11-13,23,25H,1-3,9-10,14-21H2