methyl 4-(1-benzothiophen-3-yl)-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-(1-benzothiophen-3-yl)-4-oxidanylidene-butanoate Openeye Name: methyl 4-(benzothiophen-3-yl)-4-oxo-butanoate CAS Name: 4-(1-benzothiophen-3-yl)-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-(1-benzothiophen-3-yl)-4-oxobutanoate Traditional Name: 4-(benzothiophen-3-yl)-4-keto-butyric acid methyl ester Formula: C13H12O3S MolecularWeight: 248.29758

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=O)C1=CSC2=CC=CC=C21

Isomeric SMILES

COC(=O)CCC(=O)C1=CSC2=CC=CC=C21

InChI

InChI=1S/C13H12O3S/c1-16-13(15)7-6-11(14)10-8-17-12-5-3-2-4-9(10)12/h2-5,8H,6-7H2,1H3