1-[4-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)butan-2-yl]piperidine-2-carboxylic acid

Systemtic Name: 1-[4-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)butan-2-yl]piperidine-2-carboxylic acid Openeye Name: 1-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-1-methyl-propyl]piperidine-2-carboxylic acid CAS Name: 1-[4-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)butan-2-yl]-2-piperidinecarboxylic acid IUPAC Name: 1-[4-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)butan-2-yl]piperidine-2-carboxylic acid Traditional Name: 1-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-1-methyl-propyl]pipecolinic acid Formula: C24H30N2O2 MolecularWeight: 378.5072

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN1C2=CC=CC=C2CCC3=CC=CC=C31)N4CCCCC4C(=O)O

Isomeric SMILES

CC(CCN1C2=CC=CC=C2CCC3=CC=CC=C31)N4CCCCC4C(=O)O

InChI

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