3-[4-(4-cyanophenyl)carbonylphenoxy]-4,5-bis(oxidanyl)oxan-2-olate

Systemtic Name: 3-[4-(4-cyanophenyl)carbonylphenoxy]-4,5-bis(oxidanyl)oxan-2-olate Openeye Name: 3-[4-(4-cyanobenzoyl)phenoxy]-4,5-dihydroxy-tetrahydropyran-2-olate CAS Name: 3-[4-[(4-cyanophenyl)-oxomethyl]phenoxy]-4,5-dihydroxy-2-oxanolate IUPAC Name: 3-[4-(4-cyanobenzoyl)phenoxy]-4,5-dihydroxyoxan-2-olate Traditional Name: 3-[4-(4-cyanobenzoyl)phenoxy]-4,5-dihydroxy-tetrahydropyran-2-olate Formula: C19H16NO6- MolecularWeight: 354.33344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16NO6/c20-9-11-1-3-12(4-2-11)16(22)13-5-7-14(8-6-13)26-18-17(23)15(21)10-25-19(18)24/h1-8,15,17-19,21,23H,10H2/q-1