1-[3-[(2-methylphenyl)methyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-4-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]butan-1-one

Systemtic Name: 1-[3-[(2-methylphenyl)methyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-4-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]butan-1-one Openeye Name: 1-[3-(o-tolylmethyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-4-[1-[[2-(trifluoromethyl)phenyl]methyl]-4-piperidyl]butan-1-one CAS Name: 1-[3-[(2-methylphenyl)methyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-4-[1-[[2-(trifluoromethyl)phenyl]methyl]-4-piperidinyl]-1-butanone IUPAC Name: 1-[3-[(2-methylphenyl)methyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-4-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]butan-1-one Traditional Name: 1-[3-(2-methylbenzyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-4-[1-[2-(trifluoromethyl)benzyl]-4-piperidyl]butan-1-one Formula: C35H41F3N2O MolecularWeight: 562.70805

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCC3=C(CC2)C=C(C=C3)C(=O)CCCC4CCN(CC4)CC5=CC=CC=C5C(F)(F)F

Isomeric SMILES

CC1=CC=CC=C1CN2CCC3=C(CC2)C=C(C=C3)C(=O)CCCC4CCN(CC4)CC5=CC=CC=C5C(F)(F)F

InChI

InChI=1S/C35H41F3N2O/c1-26-7-2-3-9-31(26)24-40-21-17-28-13-14-30(23-29(28)18-22-40)34(41)12-6-8-27-15-19-39(20-16-27)25-32-10-4-5-11-33(32)35(36,37)38/h2-5,7,9-11,13-14,23,27H,6,8,12,15-22,24-25H2,1H3