methyl 2-(5-chloranyl-2-oxidanyl-phenyl)-2,3-dihydro-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 2-(5-chloranyl-2-oxidanyl-phenyl)-2,3-dihydro-1-benzothiophene-3-carboxylate Openeye Name: methyl 2-(5-chloro-2-hydroxy-phenyl)-2,3-dihydrobenzothiophene-3-carboxylate CAS Name: 2-(5-chloro-2-hydroxyphenyl)-2,3-dihydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-(5-chloro-2-hydroxyphenyl)-2,3-dihydro-1-benzothiophene-3-carboxylate Traditional Name: 2-(5-chloro-2-hydroxy-phenyl)-2,3-dihydrobenzothiophene-3-carboxylic acid methyl ester Formula: C16H13ClO3S MolecularWeight: 320.79062

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(SC2=CC=CC=C12)C3=C(C=CC(=C3)Cl)O

Isomeric SMILES

COC(=O)C1C(SC2=CC=CC=C12)C3=C(C=CC(=C3)Cl)O

InChI

InChI=1S/C16H13ClO3S/c1-20-16(19)14-10-4-2-3-5-13(10)21-15(14)11-8-9(17)6-7-12(11)18/h2-8,14-15,18H,1H3