2-[(2-carboxy-4-ethanoyl-phenyl)disulfanyl]-5-ethanoyl-benzoic acid

Systemtic Name: 2-[(2-carboxy-4-ethanoyl-phenyl)disulfanyl]-5-ethanoyl-benzoic acid Openeye Name: 5-acetyl-2-[(4-acetyl-2-carboxy-phenyl)disulfanyl]benzoic acid CAS Name: 5-acetyl-2-[(4-acetyl-2-carboxyphenyl)disulfanyl]benzoic acid IUPAC Name: 5-acetyl-2-[(4-acetyl-2-carboxyphenyl)disulfanyl]benzoic acid Traditional Name: 5-acetyl-2-[(4-acetyl-2-carboxy-phenyl)disulfanyl]benzoic acid Formula: C18H14O6S2 MolecularWeight: 390.43016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)SSC2=C(C=C(C=C2)C(=O)C)C(=O)O)C(=O)O

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)SSC2=C(C=C(C=C2)C(=O)C)C(=O)O)C(=O)O

InChI

InChI=1S/C18H14O6S2/c1-9(19)11-3-5-15(13(7-11)17(21)22)25-26-16-6-4-12(10(2)20)8-14(16)18(23)24/h3-8H,1-2H3,(H,21,22)(H,23,24)