2-methyl-3-(1-phenethylsulfonyl-2-phenyl-ethyl)sulfonyl-propanoic acid

Systemtic Name: 2-methyl-3-(1-phenethylsulfonyl-2-phenyl-ethyl)sulfonyl-propanoic acid Openeye Name: 2-methyl-3-(1-phenethylsulfonyl-2-phenyl-ethyl)sulfonyl-propanoic acid CAS Name: 2-methyl-3-(1-phenethylsulfonyl-2-phenylethyl)sulfonylpropanoic acid IUPAC Name: 2-methyl-3-(1-phenethylsulfonyl-2-phenylethyl)sulfonylpropanoic acid Traditional Name: 2-methyl-3-(1-phenethylsulfonyl-2-phenyl-ethyl)sulfonyl-propionic acid Formula: C20H24O6S2 MolecularWeight: 424.53096

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS(=O)(=O)C(CC1=CC=CC=C1)S(=O)(=O)CCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(CS(=O)(=O)C(CC1=CC=CC=C1)S(=O)(=O)CCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C20H24O6S2/c1-16(20(21)22)15-28(25,26)19(14-18-10-6-3-7-11-18)27(23,24)13-12-17-8-4-2-5-9-17/h2-11,16,19H,12-15H2,1H3,(H,21,22)