methyl 2-(1-benzothiophen-3-yl)-3-oxidanylidene-butanoate

Systemtic Name: methyl 2-(1-benzothiophen-3-yl)-3-oxidanylidene-butanoate Openeye Name: methyl 2-(benzothiophen-3-yl)-3-oxo-butanoate CAS Name: 2-(1-benzothiophen-3-yl)-3-oxobutanoic acid methyl ester IUPAC Name: methyl 2-(1-benzothiophen-3-yl)-3-oxobutanoate Traditional Name: 2-(benzothiophen-3-yl)-3-keto-butyric acid methyl ester Formula: C13H12O3S MolecularWeight: 248.29758

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C1=CSC2=CC=CC=C21)C(=O)OC

Isomeric SMILES

CC(=O)C(C1=CSC2=CC=CC=C21)C(=O)OC

InChI

InChI=1S/C13H12O3S/c1-8(14)12(13(15)16-2)10-7-17-11-6-4-3-5-9(10)11/h3-7,12H,1-2H3