dimethyl 2-(2,3-dihydro-1-benzothiophen-5-yl)-2-oxidanyl-propanedioate

Systemtic Name: dimethyl 2-(2,3-dihydro-1-benzothiophen-5-yl)-2-oxidanyl-propanedioate Openeye Name: dimethyl 2-(2,3-dihydrobenzothiophen-5-yl)-2-hydroxy-propanedioate CAS Name: 2-(2,3-dihydro-1-benzothiophen-5-yl)-2-hydroxypropanedioic acid dimethyl ester IUPAC Name: dimethyl 2-(2,3-dihydro-1-benzothiophen-5-yl)-2-hydroxypropanedioate Traditional Name: 2-(2,3-dihydrobenzothiophen-5-yl)-2-hydroxy-malonic acid dimethyl ester Formula: C13H14O5S MolecularWeight: 282.31226

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC2=C(C=C1)SCC2)(C(=O)OC)O

Isomeric SMILES

COC(=O)C(C1=CC2=C(C=C1)SCC2)(C(=O)OC)O

InChI

InChI=1S/C13H14O5S/c1-17-11(14)13(16,12(15)18-2)9-3-4-10-8(7-9)5-6-19-10/h3-4,7,16H,5-6H2,1-2H3