2-[2-[2-(carboxymethyl)-6-methyl-phenyl]sulfanyl-3-methyl-phenyl]ethanoic acid

Systemtic Name: 2-[2-[2-(carboxymethyl)-6-methyl-phenyl]sulfanyl-3-methyl-phenyl]ethanoic acid Openeye Name: 2-[2-[2-(carboxymethyl)-6-methyl-phenyl]sulfanyl-3-methyl-phenyl]acetic acid CAS Name: 2-[2-[[2-(carboxymethyl)-6-methylphenyl]thio]-3-methylphenyl]acetic acid IUPAC Name: 2-[2-[2-(carboxymethyl)-6-methylphenyl]sulfanyl-3-methylphenyl]acetic acid Traditional Name: 2-[2-[[2-(carboxymethyl)-6-methyl-phenyl]thio]-3-methyl-phenyl]acetic acid Formula: C18H18O4S MolecularWeight: 330.39812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)CC(=O)O)SC2=C(C=CC=C2CC(=O)O)C

Isomeric SMILES

CC1=C(C(=CC=C1)CC(=O)O)SC2=C(C=CC=C2CC(=O)O)C

InChI

InChI=1S/C18H18O4S/c1-11-5-3-7-13(9-15(19)20)17(11)23-18-12(2)6-4-8-14(18)10-16(21)22/h3-8H,9-10H2,1-2H3,(H,19,20)(H,21,22)