4-(1,1-diphenylethoxy)-4-oxidanylidene-3-sulfo-butanoic acid

Systemtic Name: 4-(1,1-diphenylethoxy)-4-oxidanylidene-3-sulfo-butanoic acid Openeye Name: 4-(1,1-diphenylethoxy)-4-oxo-3-sulfo-butanoic acid CAS Name: 4-(1,1-diphenylethoxy)-4-oxo-3-sulfobutanoic acid IUPAC Name: 4-(1,1-diphenylethoxy)-4-oxo-3-sulfobutanoic acid Traditional Name: 4-(1,1-diphenylethoxy)-4-keto-3-sulfo-butyric acid Formula: C18H18O7S MolecularWeight: 378.39632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18O7S/c1-18(13-8-4-2-5-9-13,14-10-6-3-7-11-14)25-17(21)15(12-16(19)20)26(22,23)24/h2-11,15H,12H2,1H3,(H,19,20)(H,22,23,24)