4-methyl-2-(4-methylphenyl)sulfonyl-5-phenyl-pentanoic acid

Systemtic Name: 4-methyl-2-(4-methylphenyl)sulfonyl-5-phenyl-pentanoic acid Openeye Name: 4-methyl-5-phenyl-2-(p-tolylsulfonyl)pentanoic acid CAS Name: 4-methyl-2-(4-methylphenyl)sulfonyl-5-phenylpentanoic acid IUPAC Name: 4-methyl-2-(4-methylphenyl)sulfonyl-5-phenylpentanoic acid Traditional Name: 4-methyl-5-phenyl-2-tosyl-valeric acid Formula: C19H22O4S MolecularWeight: 346.44058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CC(C)CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CC(C)CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C19H22O4S/c1-14-8-10-17(11-9-14)24(22,23)18(19(20)21)13-15(2)12-16-6-4-3-5-7-16/h3-11,15,18H,12-13H2,1-2H3,(H,20,21)