ethyl (3S)-1-oxidanylidene-3,4-dihydroisochromene-3-carboxylate

Systemtic Name: ethyl (3S)-1-oxidanylidene-3,4-dihydroisochromene-3-carboxylate Openeye Name: ethyl (3S)-1-oxoisochromane-3-carboxylate CAS Name: (3S)-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-oxo-3,4-dihydroisochromene-3-carboxylate Traditional Name: (3S)-1-ketoisochroman-3-carboxylic acid ethyl ester Formula: C12H12O4 MolecularWeight: 220.22128

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC2=CC=CC=C2C(=O)O1

Isomeric SMILES

CCOC(=O)[C@@H]1CC2=CC=CC=C2C(=O)O1

InChI

InChI=1S/C12H12O4/c1-2-15-12(14)10-7-8-5-3-4-6-9(8)11(13)16-10/h3-6,10H,2,7H2,1H3/t10-/m0/s1