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

Systemtic Name: 2-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl-methyl-amino]pyridine-3-carboxylic acid Openeye Name: 2-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl-methyl-amino]pyridine-3-carboxylic acid CAS Name: 2-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl-methylamino]-3-pyridinecarboxylic acid IUPAC Name: 2-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl-methylamino]pyridine-3-carboxylic acid Traditional Name: 2-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl-methyl-amino]nicotinic acid Formula: C24H25N3O2 MolecularWeight: 387.4742

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCN1C2=CC=CC=C2CCC3=CC=CC=C31)C4=C(C=CC=N4)C(=O)O

Isomeric SMILES

CN(CCCN1C2=CC=CC=C2CCC3=CC=CC=C31)C4=C(C=CC=N4)C(=O)O

InChI

InChI=1S/C24H25N3O2/c1-26(23-20(24(28)29)10-6-15-25-23)16-7-17-27-21-11-4-2-8-18(21)13-14-19-9-3-5-12-22(19)27/h2-6,8-12,15H,7,13-14,16-17H2,1H3,(H,28,29)