methyl 2-(1-oxidanylidene-3,4-dihydroisochromen-3-yl)ethanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CC2=CC=CC=C2C(=O)O1

Isomeric SMILES

COC(=O)CC1CC2=CC=CC=C2C(=O)O1

InChI

InChI=1S/C12H12O4/c1-15-11(13)7-9-6-8-4-2-3-5-10(8)12(14)16-9/h2-5,9H,6-7H2,1H3