3-[2-(4-methoxyphenyl)sulfonylethylsulfonyl]benzoic acid

Systemtic Name: 3-[2-(4-methoxyphenyl)sulfonylethylsulfonyl]benzoic acid Openeye Name: 3-[2-(4-methoxyphenyl)sulfonylethylsulfonyl]benzoic acid CAS Name: 3-[2-(4-methoxyphenyl)sulfonylethylsulfonyl]benzoic acid IUPAC Name: 3-[2-(4-methoxyphenyl)sulfonylethylsulfonyl]benzoic acid Traditional Name: 3-[2-(4-methoxyphenyl)sulfonylethylsulfonyl]benzoic acid Formula: C16H16O7S2 MolecularWeight: 384.42404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)CCS(=O)(=O)C2=CC=CC(=C2)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)CCS(=O)(=O)C2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C16H16O7S2/c1-23-13-5-7-14(8-6-13)24(19,20)9-10-25(21,22)15-4-2-3-12(11-15)16(17)18/h2-8,11H,9-10H2,1H3,(H,17,18)