S-[(3-oxidanyl-1-benzofuran-2-yl)methyl] benzenecarbothioate

Systemtic Name: S-[(3-oxidanyl-1-benzofuran-2-yl)methyl] benzenecarbothioate Openeye Name: S-[(3-hydroxybenzofuran-2-yl)methyl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[(3-hydroxy-2-benzofuranyl)methyl] ester IUPAC Name: S-[(3-hydroxy-1-benzofuran-2-yl)methyl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[(3-hydroxybenzofuran-2-yl)methyl] ester Formula: C16H12O3S MolecularWeight: 284.32968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)SCC2=C(C3=CC=CC=C3O2)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)SCC2=C(C3=CC=CC=C3O2)O

InChI

InChI=1S/C16H12O3S/c17-15-12-8-4-5-9-13(12)19-14(15)10-20-16(18)11-6-2-1-3-7-11/h1-9,17H,10H2