2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)pyridine-3-carboxylic acid

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)pyridine-3-carboxylic acid Openeye Name: 2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)pyridine-3-carboxylic acid CAS Name: 2-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-3-pyridinecarboxylic acid IUPAC Name: 2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)pyridine-3-carboxylic acid Traditional Name: 2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)nicotinic acid Formula: C16H14N2O3 MolecularWeight: 282.29396

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=C(C=CC=N3)C(=O)O

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=C(C=CC=N3)C(=O)O

InChI

InChI=1S/C16H14N2O3/c19-15(14-13(16(20)21)6-3-8-17-14)18-9-7-11-4-1-2-5-12(11)10-18/h1-6,8H,7,9-10H2,(H,20,21)