(phenylmethyl) 1-oxidanylidene-2H-isoquinoline-3-carboxylate

Systemtic Name: (phenylmethyl) 1-oxidanylidene-2H-isoquinoline-3-carboxylate Openeye Name: benzyl 1-oxo-2H-isoquinoline-3-carboxylate CAS Name: 1-oxo-2H-isoquinoline-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-oxo-2H-isoquinoline-3-carboxylate Traditional Name: 1-keto-2H-isoquinoline-3-carboxylic acid benzyl ester Formula: C17H13NO3 MolecularWeight: 279.29002

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C2=CC3=CC=CC=C3C(=O)N2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C2=CC3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C17H13NO3/c19-16-14-9-5-4-8-13(14)10-15(18-16)17(20)21-11-12-6-2-1-3-7-12/h1-10H,11H2,(H,18,19)