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

Systemtic Name: 4-[1-[(2-chlorophenyl)methyl]piperidin-4-yl]-1-[3-[(2-methylphenyl)methyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]butan-1-one Openeye Name: 4-[1-[(2-chlorophenyl)methyl]-4-piperidyl]-1-[3-(o-tolylmethyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]butan-1-one CAS Name: 4-[1-[(2-chlorophenyl)methyl]-4-piperidinyl]-1-[3-[(2-methylphenyl)methyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-1-butanone IUPAC Name: 4-[1-[(2-chlorophenyl)methyl]piperidin-4-yl]-1-[3-[(2-methylphenyl)methyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]butan-1-one Traditional Name: 4-[1-(2-chlorobenzyl)-4-piperidyl]-1-[3-(2-methylbenzyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]butan-1-one Formula: C34H41ClN2O MolecularWeight: 529.15514

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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=C5Cl

Isomeric SMILES

CC1=CC=CC=C1CN2CCC3=C(CC2)C=C(C=C3)C(=O)CCCC4CCN(CC4)CC5=CC=CC=C5Cl

InChI

InChI=1S/C34H41ClN2O/c1-26-7-2-3-9-31(26)24-37-21-17-28-13-14-30(23-29(28)18-22-37)34(38)12-6-8-27-15-19-36(20-16-27)25-32-10-4-5-11-33(32)35/h2-5,7,9-11,13-14,23,27H,6,8,12,15-22,24-25H2,1H3