methyl 4-methoxy-2-methyl-1-oxidanylidene-isoquinoline-3-carboxylate

Systemtic Name: methyl 4-methoxy-2-methyl-1-oxidanylidene-isoquinoline-3-carboxylate Openeye Name: methyl 4-methoxy-2-methyl-1-oxo-isoquinoline-3-carboxylate CAS Name: 4-methoxy-2-methyl-1-oxo-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-methoxy-2-methyl-1-oxoisoquinoline-3-carboxylate Traditional Name: 1-keto-4-methoxy-2-methyl-isoquinoline-3-carboxylic acid methyl ester Formula: C13H13NO4 MolecularWeight: 247.24662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=CC=CC=C2C1=O)OC)C(=O)OC

Isomeric SMILES

CN1C(=C(C2=CC=CC=C2C1=O)OC)C(=O)OC

InChI

InChI=1S/C13H13NO4/c1-14-10(13(16)18-3)11(17-2)8-6-4-5-7-9(8)12(14)15/h4-7H,1-3H3