7-(3-methoxyphenyl)-2-(4-methoxyphenyl)sulfonyl-heptanoic acid

Systemtic Name: 7-(3-methoxyphenyl)-2-(4-methoxyphenyl)sulfonyl-heptanoic acid Openeye Name: 7-(3-methoxyphenyl)-2-(4-methoxyphenyl)sulfonyl-heptanoic acid CAS Name: 7-(3-methoxyphenyl)-2-(4-methoxyphenyl)sulfonylheptanoic acid IUPAC Name: 7-(3-methoxyphenyl)-2-(4-methoxyphenyl)sulfonylheptanoic acid Traditional Name: 7-(3-methoxyphenyl)-2-(4-methoxyphenyl)sulfonyl-enanthic acid Formula: C21H26O6S MolecularWeight: 406.49254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)C(CCCCCC2=CC(=CC=C2)OC)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)C(CCCCCC2=CC(=CC=C2)OC)C(=O)O

InChI

InChI=1S/C21H26O6S/c1-26-17-11-13-19(14-12-17)28(24,25)20(21(22)23)10-5-3-4-7-16-8-6-9-18(15-16)27-2/h6,8-9,11-15,20H,3-5,7,10H2,1-2H3,(H,22,23)