potassium (2,3-diphenyl-5-sulfooxy-cyclopenten-1-yl) ethanoate

Systemtic Name: potassium (2,3-diphenyl-5-sulfooxy-cyclopenten-1-yl) ethanoate Openeye Name: potassium (2,3-diphenyl-5-sulfooxy-cyclopenten-1-yl) acetate CAS Name: potassium acetic acid (2,3-diphenyl-5-sulfooxy-1-cyclopentenyl) ester IUPAC Name: potassium (2,3-diphenyl-5-sulfooxycyclopenten-1-yl) acetate Traditional Name: potassium acetic acid (2,3-diphenyl-5-sulfoxy-cyclopenten-1-yl) ester Formula: C19H18KO6S+ MolecularWeight: 413.50592

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C(CC1OS(=O)(=O)O)C2=CC=CC=C2)C3=CC=CC=C3.[K+]

Isomeric SMILES

CC(=O)OC1=C(C(CC1OS(=O)(=O)O)C2=CC=CC=C2)C3=CC=CC=C3.[K+]

InChI

InChI=1S/C19H18O6S.K/c1-13(20)24-19-17(25-26(21,22)23)12-16(14-8-4-2-5-9-14)18(19)15-10-6-3-7-11-15;/h2-11,16-17H,12H2,1H3,(H,21,22,23);/q;+1