2-[1-methoxy-3-(4-methylphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-2-phenyl-ethanoic acid

Systemtic Name: 2-[1-methoxy-3-(4-methylphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-2-phenyl-ethanoic acid Openeye Name: 2-[2-methoxy-2-oxo-1-(p-tolylmethyl)ethyl]sulfanyl-2-phenyl-acetic acid CAS Name: 2-[[1-methoxy-3-(4-methylphenyl)-1-oxopropan-2-yl]thio]-2-phenylacetic acid IUPAC Name: 2-[1-methoxy-3-(4-methylphenyl)-1-oxopropan-2-yl]sulfanyl-2-phenylacetic acid Traditional Name: 2-[[2-keto-2-methoxy-1-(4-methylbenzyl)ethyl]thio]-2-phenyl-acetic acid Formula: C19H20O4S MolecularWeight: 344.4247

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(C(=O)OC)SC(C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)CC(C(=O)OC)SC(C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C19H20O4S/c1-13-8-10-14(11-9-13)12-16(19(22)23-2)24-17(18(20)21)15-6-4-3-5-7-15/h3-11,16-17H,12H2,1-2H3,(H,20,21)