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

Systemtic Name: 2-[(2-carboxy-5-ethoxy-phenyl)disulfanyl]-4-ethoxy-benzoic acid Openeye Name: 2-[(2-carboxy-5-ethoxy-phenyl)disulfanyl]-4-ethoxy-benzoic acid CAS Name: 2-[(2-carboxy-5-ethoxyphenyl)disulfanyl]-4-ethoxybenzoic acid IUPAC Name: 2-[(2-carboxy-5-ethoxyphenyl)disulfanyl]-4-ethoxybenzoic acid Traditional Name: 2-[(2-carboxy-5-ethoxy-phenyl)disulfanyl]-4-ethoxy-benzoic acid Formula: C18H18O6S2 MolecularWeight: 394.46192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)C(=O)O)SSC2=C(C=CC(=C2)OCC)C(=O)O

Isomeric SMILES

CCOC1=CC(=C(C=C1)C(=O)O)SSC2=C(C=CC(=C2)OCC)C(=O)O

InChI

InChI=1S/C18H18O6S2/c1-3-23-11-5-7-13(17(19)20)15(9-11)25-26-16-10-12(24-4-2)6-8-14(16)18(21)22/h5-10H,3-4H2,1-2H3,(H,19,20)(H,21,22)