(6-methyl-2-oxidanylidene-pyran-3-yl) benzoate

Systemtic Name: (6-methyl-2-oxidanylidene-pyran-3-yl) benzoate Openeye Name: (6-methyl-2-oxo-pyran-3-yl) benzoate CAS Name: benzoic acid (6-methyl-2-oxo-3-pyranyl) ester IUPAC Name: (6-methyl-2-oxopyran-3-yl) benzoate Traditional Name: benzoic acid (2-keto-6-methyl-pyran-3-yl) ester Formula: C13H10O4 MolecularWeight: 230.2161

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10O4/c1-9-7-8-11(13(15)16-9)17-12(14)10-5-3-2-4-6-10/h2-8H,1H3