1-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propanoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propanoyl]piperidine-4-carboxylic acid Openeye Name: 1-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propanoyl]piperidine-4-carboxylic acid CAS Name: 1-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-1-oxopropyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propanoyl]piperidine-4-carboxylic acid Traditional Name: 1-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propanoyl]isonipecotic acid Formula: C23H26N2O3 MolecularWeight: 378.46414

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)CCN2C3=CC=CC=C3CCC4=CC=CC=C42

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)CCN2C3=CC=CC=C3CCC4=CC=CC=C42

InChI

InChI=1S/C23H26N2O3/c26-22(24-14-11-19(12-15-24)23(27)28)13-16-25-20-7-3-1-5-17(20)9-10-18-6-2-4-8-21(18)25/h1-8,19H,9-16H2,(H,27,28)