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

Systemtic Name: 1-[3-[(2-methylphenyl)methyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-4-[1-(phenylmethyl)piperidin-4-yl]butan-1-one Openeye Name: 4-(1-benzyl-4-piperidyl)-1-[3-(o-tolylmethyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]butan-1-one CAS Name: 1-[3-[(2-methylphenyl)methyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-4-[1-(phenylmethyl)-4-piperidinyl]-1-butanone IUPAC Name: 4-(1-benzylpiperidin-4-yl)-1-[3-[(2-methylphenyl)methyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]butan-1-one Traditional Name: 4-(1-benzyl-4-piperidyl)-1-[3-(2-methylbenzyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]butan-1-one Formula: C34H42N2O MolecularWeight: 494.71008

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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=C5

Isomeric SMILES

CC1=CC=CC=C1CN2CCC3=C(CC2)C=C(C=C3)C(=O)CCCC4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C34H42N2O/c1-27-8-5-6-12-33(27)26-36-22-18-30-14-15-32(24-31(30)19-23-36)34(37)13-7-11-28-16-20-35(21-17-28)25-29-9-3-2-4-10-29/h2-6,8-10,12,14-15,24,28H,7,11,13,16-23,25-26H2,1H3