methyl 7-oxidanyl-1-oxidanylidene-3-phenyl-isochromene-8-carboxylate

Systemtic Name: methyl 7-oxidanyl-1-oxidanylidene-3-phenyl-isochromene-8-carboxylate Openeye Name: methyl 7-hydroxy-1-oxo-3-phenyl-isochromene-8-carboxylate CAS Name: 7-hydroxy-1-oxo-3-phenyl-2-benzopyran-8-carboxylic acid methyl ester IUPAC Name: methyl 7-hydroxy-1-oxo-3-phenylisochromene-8-carboxylate Traditional Name: 7-hydroxy-1-keto-3-phenyl-isochromene-8-carboxylic acid methyl ester Formula: C17H12O5 MolecularWeight: 296.27418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC2=C1C(=O)OC(=C2)C3=CC=CC=C3)O

Isomeric SMILES

COC(=O)C1=C(C=CC2=C1C(=O)OC(=C2)C3=CC=CC=C3)O

InChI

InChI=1S/C17H12O5/c1-21-16(19)15-12(18)8-7-11-9-13(22-17(20)14(11)15)10-5-3-2-4-6-10/h2-9,18H,1H3