methyl 1-oxidanylidene-2-phenyl-isoquinoline-4-carboxylate

Systemtic Name: methyl 1-oxidanylidene-2-phenyl-isoquinoline-4-carboxylate Openeye Name: methyl 1-oxo-2-phenyl-isoquinoline-4-carboxylate CAS Name: 1-oxo-2-phenyl-4-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 1-oxo-2-phenylisoquinoline-4-carboxylate Traditional Name: 1-keto-2-phenyl-isoquinoline-4-carboxylic acid methyl ester Formula: C17H13NO3 MolecularWeight: 279.29002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C(=O)C2=CC=CC=C21)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CN(C(=O)C2=CC=CC=C21)C3=CC=CC=C3

InChI

InChI=1S/C17H13NO3/c1-21-17(20)15-11-18(12-7-3-2-4-8-12)16(19)14-10-6-5-9-13(14)15/h2-11H,1H3