methyl 3-methyl-1-oxidanylidene-3-phenyl-4H-isochromene-4-carboxylate

Systemtic Name: methyl 3-methyl-1-oxidanylidene-3-phenyl-4H-isochromene-4-carboxylate Openeye Name: methyl 3-methyl-1-oxo-3-phenyl-isochromane-4-carboxylate CAS Name: 3-methyl-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-4-carboxylic acid methyl ester IUPAC Name: methyl 3-methyl-1-oxo-3-phenyl-4H-isochromene-4-carboxylate Traditional Name: 1-keto-3-methyl-3-phenyl-isochroman-4-carboxylic acid methyl ester Formula: C18H16O4 MolecularWeight: 296.31724

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C2=CC=CC=C2C(=O)O1)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1(C(C2=CC=CC=C2C(=O)O1)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C18H16O4/c1-18(12-8-4-3-5-9-12)15(17(20)21-2)13-10-6-7-11-14(13)16(19)22-18/h3-11,15H,1-2H3