2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-4-yl]amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-4-yl]amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-pyridyl]amino]-2-oxo-acetic acid CAS Name: 2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-pyridinyl]amino]-2-oxoacetic acid IUPAC Name: 2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-4-yl]amino]-2-oxoacetic acid Traditional Name: 2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-pyridyl]amino]-2-keto-acetic acid Formula: C16H15N3O3 MolecularWeight: 297.3086

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O3/c20-15(16(21)22)18-13-5-7-17-14(9-13)19-8-6-11-3-1-2-4-12(11)10-19/h1-5,7,9H,6,8,10H2,(H,21,22)(H,17,18,20)