1-[1-(3-benzo[b][1]benzazepin-11-ylpropyl)-4-phenyl-piperidin-4-yl]ethanone hydrochloride

Systemtic Name: 1-[1-(3-benzo[b][1]benzazepin-11-ylpropyl)-4-phenyl-piperidin-4-yl]ethanone hydrochloride Openeye Name: 1-[1-(3-benzo[b][1]benzazepin-11-ylpropyl)-4-phenyl-4-piperidyl]ethanone hydrochloride CAS Name: 1-[1-[3-(11-benzo[b][1]benzazepinyl)propyl]-4-phenyl-4-piperidinyl]ethanone hydrochloride IUPAC Name: 1-[1-(3-benzo[b][1]benzazepin-11-ylpropyl)-4-phenylpiperidin-4-yl]ethanone hydrochloride Traditional Name: 1-[1-(3-benzo[b][1]benzazepin-11-ylpropyl)-4-phenyl-4-piperidyl]ethanone hydrochloride Formula: C30H33ClN2O MolecularWeight: 473.04882

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(CCN(CC1)CCCN2C3=CC=CC=C3C=CC4=CC=CC=C42)C5=CC=CC=C5.Cl

Isomeric SMILES

CC(=O)C1(CCN(CC1)CCCN2C3=CC=CC=C3C=CC4=CC=CC=C42)C5=CC=CC=C5.Cl

InChI

InChI=1S/C30H32N2O.ClH/c1-24(33)30(27-12-3-2-4-13-27)18-22-31(23-19-30)20-9-21-32-28-14-7-5-10-25(28)16-17-26-11-6-8-15-29(26)32;/h2-8,10-17H,9,18-23H2,1H3;1H