2-methyl-2-(4-oxidanylidene-3-phenyl-4-phenylmethoxy-butyl)sulfonyl-propanoic acid

Systemtic Name: 2-methyl-2-(4-oxidanylidene-3-phenyl-4-phenylmethoxy-butyl)sulfonyl-propanoic acid Openeye Name: 2-(4-benzyloxy-4-oxo-3-phenyl-butyl)sulfonyl-2-methyl-propanoic acid CAS Name: 2-methyl-2-(4-oxo-3-phenyl-4-phenylmethoxybutyl)sulfonylpropanoic acid IUPAC Name: 2-methyl-2-(4-oxo-3-phenyl-4-phenylmethoxybutyl)sulfonylpropanoic acid Traditional Name: 2-(4-benzoxy-4-keto-3-phenyl-butyl)sulfonyl-2-methyl-propionic acid Formula: C21H24O6S MolecularWeight: 404.47666

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)S(=O)(=O)CCC(C1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C(=O)O)S(=O)(=O)CCC(C1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H24O6S/c1-21(2,20(23)24)28(25,26)14-13-18(17-11-7-4-8-12-17)19(22)27-15-16-9-5-3-6-10-16/h3-12,18H,13-15H2,1-2H3,(H,23,24)