1-oxidanylidene-3,3-diphenyl-2,1$l^{4}-benzoxathiole-7-carboxylic acid

Systemtic Name: 1-oxidanylidene-3,3-diphenyl-2,1$l^{4}-benzoxathiole-7-carboxylic acid Openeye Name: 1-oxo-3,3-diphenyl-2,1$l^{4}-benzoxathiole-7-carboxylic acid CAS Name: 1-oxo-3,3-diphenyl-2,1$l^{4}-benzoxathiole-7-carboxylic acid IUPAC Name: 1-oxo-3,3-diphenyl-2,1$l^{4}-benzoxathiole-7-carboxylic acid Traditional Name: 1-keto-3,3-diphenyl-2,1$l^{4}-benzoxathiole-7-carboxylic acid Formula: C20H14O4S MolecularWeight: 350.38776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2(C3=CC=CC(=C3S(=O)O2)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2(C3=CC=CC(=C3S(=O)O2)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C20H14O4S/c21-19(22)16-12-7-13-17-18(16)25(23)24-20(17,14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-13H,(H,21,22)