3-[(3-carboxy-2-methyl-phenyl)disulfanyl]-2-methyl-benzoic acid

Systemtic Name: 3-[(3-carboxy-2-methyl-phenyl)disulfanyl]-2-methyl-benzoic acid Openeye Name: 3-[(3-carboxy-2-methyl-phenyl)disulfanyl]-2-methyl-benzoic acid CAS Name: 3-[(3-carboxy-2-methylphenyl)disulfanyl]-2-methylbenzoic acid IUPAC Name: 3-[(3-carboxy-2-methylphenyl)disulfanyl]-2-methylbenzoic acid Traditional Name: 3-[(3-carboxy-2-methyl-phenyl)disulfanyl]-2-methyl-benzoic acid Formula: C16H14O4S2 MolecularWeight: 334.40996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1SSC2=CC=CC(=C2C)C(=O)O)C(=O)O

Isomeric SMILES

CC1=C(C=CC=C1SSC2=CC=CC(=C2C)C(=O)O)C(=O)O

InChI

InChI=1S/C16H14O4S2/c1-9-11(15(17)18)5-3-7-13(9)21-22-14-8-4-6-12(10(14)2)16(19)20/h3-8H,1-2H3,(H,17,18)(H,19,20)