(5-ethoxycarbonyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl)methyl quinoline-2-carboxylate

Systemtic Name: (5-ethoxycarbonyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl)methyl quinoline-2-carboxylate Openeye Name: (5-ethoxycarbonyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl)methyl quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid (5-ethoxycarbonyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl)methyl ester IUPAC Name: (5-ethoxycarbonyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl)methyl quinoline-2-carboxylate Traditional Name: quinaldic acid (5-carbethoxy-2-keto-3,4-dihydro-1H-pyrimidin-6-yl)methyl ester Formula: C18H17N3O5 MolecularWeight: 355.34468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)COC(=O)C2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)COC(=O)C2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C18H17N3O5/c1-2-25-16(22)12-9-19-18(24)21-15(12)10-26-17(23)14-8-7-11-5-3-4-6-13(11)20-14/h3-8H,2,9-10H2,1H3,(H2,19,21,24)