ethyl 6-oxidanyl-3-(phenylsulfinyl)-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 6-oxidanyl-3-(phenylsulfinyl)-1-benzothiophene-2-carboxylate Openeye Name: ethyl 3-(benzenesulfinyl)-6-hydroxy-benzothiophene-2-carboxylate CAS Name: 3-(benzenesulfinyl)-6-hydroxy-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(benzenesulfinyl)-6-hydroxy-1-benzothiophene-2-carboxylate Traditional Name: 3-(benzenesulfinyl)-6-hydroxy-benzothiophene-2-carboxylic acid ethyl ester Formula: C17H14O4S2 MolecularWeight: 346.42066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)C=C(C=C2)O)S(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)C=C(C=C2)O)S(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H14O4S2/c1-2-21-17(19)15-16(23(20)12-6-4-3-5-7-12)13-9-8-11(18)10-14(13)22-15/h3-10,18H,2H2,1H3