4-(2-methyl-3-phenyl-phenyl)sulfanylbutanoic acid

Systemtic Name: 4-(2-methyl-3-phenyl-phenyl)sulfanylbutanoic acid Openeye Name: 4-(2-methyl-3-phenyl-phenyl)sulfanylbutanoic acid CAS Name: 4-[(2-methyl-3-phenylphenyl)thio]butanoic acid IUPAC Name: 4-(2-methyl-3-phenylphenyl)sulfanylbutanoic acid Traditional Name: 4-[(2-methyl-3-phenyl-phenyl)thio]butyric acid Formula: C17H18O2S MolecularWeight: 286.38862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1SCCCC(=O)O)C2=CC=CC=C2

Isomeric SMILES

CC1=C(C=CC=C1SCCCC(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C17H18O2S/c1-13-15(14-7-3-2-4-8-14)9-5-10-16(13)20-12-6-11-17(18)19/h2-5,7-10H,6,11-12H2,1H3,(H,18,19)