5-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)methyl]pyridine-2-carboxylic acid

Systemtic Name: 5-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)methyl]pyridine-2-carboxylic acid Openeye Name: 5-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)methyl]pyridine-2-carboxylic acid CAS Name: 5-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)methyl]-2-pyridinecarboxylic acid IUPAC Name: 5-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)methyl]pyridine-2-carboxylic acid Traditional Name: 5-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)methyl]picolinic acid Formula: C21H24N2O2 MolecularWeight: 336.42746

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)N2CCC3=C(CC2)C=C(C=C3)CC4=CN=C(C=C4)C(=O)O

Isomeric SMILES

C1CC(C1)N2CCC3=C(CC2)C=C(C=C3)CC4=CN=C(C=C4)C(=O)O

InChI

InChI=1S/C21H24N2O2/c24-21(25)20-7-5-16(14-22-20)12-15-4-6-17-8-10-23(19-2-1-3-19)11-9-18(17)13-15/h4-7,13-14,19H,1-3,8-12H2,(H,24,25)