1-[3-(6-oxidanylidene-11H-benzo[c][1]benzazepin-5-yl)propyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[3-(6-oxidanylidene-11H-benzo[c][1]benzazepin-5-yl)propyl]piperidine-3-carboxylic acid Openeye Name: 1-[3-(6-oxo-11H-benzo[c][1]benzazepin-5-yl)propyl]piperidine-3-carboxylic acid CAS Name: 1-[3-(6-oxo-11H-benzo[c][1]benzazepin-5-yl)propyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[3-(6-oxo-11H-benzo[c][1]benzazepin-5-yl)propyl]piperidine-3-carboxylic acid Traditional Name: 1-[3-(6-keto-11H-benzo[c][1]benzazepin-5-yl)propyl]nipecotic acid Formula: C23H26N2O3 MolecularWeight: 378.46414

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCCN2C3=CC=CC=C3CC4=CC=CC=C4C2=O)C(=O)O

Isomeric SMILES

C1CC(CN(C1)CCCN2C3=CC=CC=C3CC4=CC=CC=C4C2=O)C(=O)O

InChI

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