(3-oxidanylidene-1,4-dihydroisochromen-1-yl) propanoate

Systemtic Name: (3-oxidanylidene-1,4-dihydroisochromen-1-yl) propanoate Openeye Name: (3-oxoisochroman-1-yl) propanoate CAS Name: propanoic acid (3-oxo-3,4-dihydro-1H-2-benzopyran-1-yl) ester IUPAC Name: (3-oxo-1,4-dihydroisochromen-1-yl) propanoate Traditional Name: propionic acid (3-ketoisochroman-1-yl) ester Formula: C12H12O4 MolecularWeight: 220.22128

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1C2=CC=CC=C2CC(=O)O1

Isomeric SMILES

CCC(=O)OC1C2=CC=CC=C2CC(=O)O1

InChI

InChI=1S/C12H12O4/c1-2-10(13)15-12-9-6-4-3-5-8(9)7-11(14)16-12/h3-6,12H,2,7H2,1H3