1-[4-(10,11-dihydrobenzo[d][1]benzazepin-5-yl)butyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[4-(10,11-dihydrobenzo[d][1]benzazepin-5-yl)butyl]piperidine-4-carboxylic acid Openeye Name: 1-[4-(10,11-dihydrobenzo[d][1]benzazepin-5-yl)butyl]piperidine-4-carboxylic acid CAS Name: 1-[4-(10,11-dihydrobenzo[d][1]benzazepin-5-yl)butyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[4-(10,11-dihydrobenzo[d][1]benzazepin-5-yl)butyl]piperidine-4-carboxylic acid Traditional Name: 1-[4-(10,11-dihydrobenzo[d][1]benzazepin-5-yl)butyl]isonipecotic acid Formula: C24H30N2O2 MolecularWeight: 378.5072

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C1)C=CN(C3=CC=CC=C23)CCCCN4CCC(CC4)C(=O)O

Isomeric SMILES

C1CC2=C(C=C1)C=CN(C3=CC=CC=C23)CCCCN4CCC(CC4)C(=O)O

InChI

InChI=1S/C24H30N2O2/c27-24(28)20-11-16-25(17-12-20)14-5-6-15-26-18-13-19-7-1-2-8-21(19)22-9-3-4-10-23(22)26/h1,3-4,7,9-10,13,18,20H,2,5-6,8,11-12,14-17H2,(H,27,28)