(2-azanyl-2-oxidanylidene-ethyl) 2-pyridin-4-ylquinoline-4-carboxylate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 2-pyridin-4-ylquinoline-4-carboxylate Openeye Name: (2-amino-2-oxo-ethyl) 2-(4-pyridyl)quinoline-4-carboxylate CAS Name: 2-pyridin-4-yl-4-quinolinecarboxylic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 2-pyridin-4-ylquinoline-4-carboxylate Traditional Name: 2-(4-pyridyl)cinchoninic acid (2-amino-2-keto-ethyl) ester Formula: C17H13N3O3 MolecularWeight: 307.30342

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=NC=C3)C(=O)OCC(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=NC=C3)C(=O)OCC(=O)N

InChI

InChI=1S/C17H13N3O3/c18-16(21)10-23-17(22)13-9-15(11-5-7-19-8-6-11)20-14-4-2-1-3-12(13)14/h1-9H,10H2,(H2,18,21)