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

Systemtic Name: 2-phenyl-1-[3-(phenylmethyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-4-piperidin-1-yl-butan-1-one dihydrochloride Openeye Name: 1-(3-benzyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-2-phenyl-4-(1-piperidyl)butan-1-one dihydrochloride CAS Name: 2-phenyl-1-[3-(phenylmethyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-4-(1-piperidinyl)-1-butanone dihydrochloride IUPAC Name: 1-(3-benzyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-2-phenyl-4-piperidin-1-ylbutan-1-one dihydrochloride Traditional Name: 1-(3-benzyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-2-phenyl-4-piperidino-butan-1-one dihydrochloride Formula: C32H40Cl2N2O MolecularWeight: 539.5788

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCC(C2=CC=CC=C2)C(=O)C3=CC4=C(CCN(CC4)CC5=CC=CC=C5)C=C3.Cl.Cl

Isomeric SMILES

C1CCN(CC1)CCC(C2=CC=CC=C2)C(=O)C3=CC4=C(CCN(CC4)CC5=CC=CC=C5)C=C3.Cl.Cl

InChI

InChI=1S/C32H38N2O.2ClH/c35-32(31(28-12-6-2-7-13-28)18-23-33-19-8-3-9-20-33)30-15-14-27-16-21-34(22-17-29(27)24-30)25-26-10-4-1-5-11-26;;/h1-2,4-7,10-15,24,31H,3,8-9,16-23,25H2;2*1H