(4-ethanoylphenyl) 3-methyl-1-oxidanylidene-4H-isochromene-3-carboxylate

Systemtic Name: (4-ethanoylphenyl) 3-methyl-1-oxidanylidene-4H-isochromene-3-carboxylate Openeye Name: (4-acetylphenyl) 3-methyl-1-oxo-isochromane-3-carboxylate CAS Name: 3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxylic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 3-methyl-1-oxo-4H-isochromene-3-carboxylate Traditional Name: 1-keto-3-methyl-isochroman-3-carboxylic acid (4-acetylphenyl) ester Formula: C19H16O5 MolecularWeight: 324.32734

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OC(=O)C2(CC3=CC=CC=C3C(=O)O2)C

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OC(=O)C2(CC3=CC=CC=C3C(=O)O2)C

InChI

InChI=1S/C19H16O5/c1-12(20)13-7-9-15(10-8-13)23-18(22)19(2)11-14-5-3-4-6-16(14)17(21)24-19/h3-10H,11H2,1-2H3