methyl 2-[(3S)-3-methyl-2-oxidanylidene-1-benzofuran-3-yl]ethanoate

Systemtic Name: methyl 2-[(3S)-3-methyl-2-oxidanylidene-1-benzofuran-3-yl]ethanoate Openeye Name: methyl 2-[(3S)-3-methyl-2-oxo-benzofuran-3-yl]acetate CAS Name: 2-[(3S)-3-methyl-2-oxo-3-benzofuranyl]acetic acid methyl ester IUPAC Name: methyl 2-[(3S)-3-methyl-2-oxo-1-benzofuran-3-yl]acetate Traditional Name: 2-[(3S)-2-keto-3-methyl-coumaran-3-yl]acetic acid methyl ester Formula: C12H12O4 MolecularWeight: 220.22128

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2OC1=O)CC(=O)OC

Isomeric SMILES

C[C@@]1(C2=CC=CC=C2OC1=O)CC(=O)OC

InChI

InChI=1S/C12H12O4/c1-12(7-10(13)15-2)8-5-3-4-6-9(8)16-11(12)14/h3-6H,7H2,1-2H3/t12-/m0/s1