3-(3,4-dimethoxyphenyl)sulfonyl-7-phenyl-2-(3-phenylpropyl)heptanoic acid

Systemtic Name: 3-(3,4-dimethoxyphenyl)sulfonyl-7-phenyl-2-(3-phenylpropyl)heptanoic acid Openeye Name: 3-(3,4-dimethoxyphenyl)sulfonyl-7-phenyl-2-(3-phenylpropyl)heptanoic acid CAS Name: 3-(3,4-dimethoxyphenyl)sulfonyl-7-phenyl-2-(3-phenylpropyl)heptanoic acid IUPAC Name: 3-(3,4-dimethoxyphenyl)sulfonyl-7-phenyl-2-(3-phenylpropyl)heptanoic acid Traditional Name: 3-(3,4-dimethoxyphenyl)sulfonyl-7-phenyl-2-(3-phenylpropyl)enanthic acid Formula: C30H36O6S MolecularWeight: 524.66824

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)C(CCCCC2=CC=CC=C2)C(CCCC3=CC=CC=C3)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)C(CCCCC2=CC=CC=C2)C(CCCC3=CC=CC=C3)C(=O)O)OC

InChI

InChI=1S/C30H36O6S/c1-35-27-21-20-25(22-28(27)36-2)37(33,34)29(19-10-9-16-23-12-5-3-6-13-23)26(30(31)32)18-11-17-24-14-7-4-8-15-24/h3-8,12-15,20-22,26,29H,9-11,16-19H2,1-2H3,(H,31,32)