3-(3,4-dimethoxyphenyl)sulfonyl-5-(4-phenylmethoxyphenyl)pentanoic acid

Systemtic Name: 3-(3,4-dimethoxyphenyl)sulfonyl-5-(4-phenylmethoxyphenyl)pentanoic acid Openeye Name: 5-(4-benzyloxyphenyl)-3-(3,4-dimethoxyphenyl)sulfonyl-pentanoic acid CAS Name: 3-(3,4-dimethoxyphenyl)sulfonyl-5-(4-phenylmethoxyphenyl)pentanoic acid IUPAC Name: 3-(3,4-dimethoxyphenyl)sulfonyl-5-(4-phenylmethoxyphenyl)pentanoic acid Traditional Name: 5-(4-benzoxyphenyl)-3-(3,4-dimethoxyphenyl)sulfonyl-valeric acid Formula: C26H28O7S MolecularWeight: 484.56132

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)C(CCC2=CC=C(C=C2)OCC3=CC=CC=C3)CC(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)C(CCC2=CC=C(C=C2)OCC3=CC=CC=C3)CC(=O)O)OC

InChI

InChI=1S/C26H28O7S/c1-31-24-15-14-22(16-25(24)32-2)34(29,30)23(17-26(27)28)13-10-19-8-11-21(12-9-19)33-18-20-6-4-3-5-7-20/h3-9,11-12,14-16,23H,10,13,17-18H2,1-2H3,(H,27,28)