2-[(4,5-diphenyl-1,3-oxazol-2-yl)carbonyloxy]-2-sulfanylcarbonyloxy-ethanoic acid

Systemtic Name: 2-[(4,5-diphenyl-1,3-oxazol-2-yl)carbonyloxy]-2-sulfanylcarbonyloxy-ethanoic acid Openeye Name: 2-(4,5-diphenyloxazole-2-carbonyl)oxy-2-sulfanylcarbonyloxy-acetic acid CAS Name: 2-[(4,5-diphenyl-2-oxazolyl)-oxomethoxy]-2-[mercapto(oxo)methoxy]acetic acid IUPAC Name: 2-(4,5-diphenyl-1,3-oxazole-2-carbonyl)oxy-2-sulfanylcarbonyloxyacetic acid Traditional Name: 2-(4,5-diphenyloxazole-2-carbonyl)oxy-2-thiocarboxyoxy-acetic acid Formula: C19H13NO7S MolecularWeight: 399.37402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(OC(=N2)C(=O)OC(C(=O)O)OC(=O)S)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C2=C(OC(=N2)C(=O)OC(C(=O)O)OC(=O)S)C3=CC=CC=C3

InChI

InChI=1S/C19H13NO7S/c21-16(22)18(27-19(24)28)26-17(23)15-20-13(11-7-3-1-4-8-11)14(25-15)12-9-5-2-6-10-12/h1-10,18H,(H,21,22)(H,24,28)