1-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl]-2-methyl-piperidine-3-carboxylic acid

Systemtic Name: 1-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl]-2-methyl-piperidine-3-carboxylic acid Openeye Name: 1-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl]-2-methyl-piperidine-3-carboxylic acid CAS Name: 1-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl]-2-methyl-3-piperidinecarboxylic acid IUPAC Name: 1-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl]-2-methylpiperidine-3-carboxylic acid Traditional Name: 1-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl]-2-methyl-nipecotic acid Formula: C24H30N2O2 MolecularWeight: 378.5072

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CCCN1CCCN2C3=CC=CC=C3CCC4=CC=CC=C42)C(=O)O

Isomeric SMILES

CC1C(CCCN1CCCN2C3=CC=CC=C3CCC4=CC=CC=C42)C(=O)O

InChI

InChI=1S/C24H30N2O2/c1-18-21(24(27)28)10-6-15-25(18)16-7-17-26-22-11-4-2-8-19(22)13-14-20-9-3-5-12-23(20)26/h2-5,8-9,11-12,18,21H,6-7,10,13-17H2,1H3,(H,27,28)