3-[4-(4-cyanophenyl)carbonylphenoxy]-4,5-bis(oxidanyl)oxane-2-thiolate

Systemtic Name: 3-[4-(4-cyanophenyl)carbonylphenoxy]-4,5-bis(oxidanyl)oxane-2-thiolate Openeye Name: 3-[4-(4-cyanobenzoyl)phenoxy]-4,5-dihydroxy-tetrahydropyran-2-thiolate CAS Name: 3-[4-[(4-cyanophenyl)-oxomethyl]phenoxy]-4,5-dihydroxy-2-oxanethiolate IUPAC Name: 3-[4-(4-cyanobenzoyl)phenoxy]-4,5-dihydroxyoxane-2-thiolate Traditional Name: 3-[4-(4-cyanobenzoyl)phenoxy]-4,5-dihydroxy-tetrahydropyran-2-thiolate Formula: C19H16NO5S- MolecularWeight: 370.39904

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C(O1)[S-])OC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)C#N)O)O

Isomeric SMILES

C1C(C(C(C(O1)[S-])OC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)C#N)O)O

InChI

InChI=1S/C19H17NO5S/c20-9-11-1-3-12(4-2-11)16(22)13-5-7-14(8-6-13)25-18-17(23)15(21)10-24-19(18)26/h1-8,15,17-19,21,23,26H,10H2/p-1