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

Systemtic Name: 3-(3,4-dimethoxyphenyl)sulfonyl-2,2-dimethyl-7-phenyl-heptanoic acid Openeye Name: 3-(3,4-dimethoxyphenyl)sulfonyl-2,2-dimethyl-7-phenyl-heptanoic acid CAS Name: 3-(3,4-dimethoxyphenyl)sulfonyl-2,2-dimethyl-7-phenylheptanoic acid IUPAC Name: 3-(3,4-dimethoxyphenyl)sulfonyl-2,2-dimethyl-7-phenylheptanoic acid Traditional Name: 3-(3,4-dimethoxyphenyl)sulfonyl-2,2-dimethyl-7-phenyl-enanthic acid Formula: C23H30O6S MolecularWeight: 434.5457

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(CCCCC1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC)OC)C(=O)O

Isomeric SMILES

CC(C)(C(CCCCC1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC)OC)C(=O)O

InChI

InChI=1S/C23H30O6S/c1-23(2,22(24)25)21(13-9-8-12-17-10-6-5-7-11-17)30(26,27)18-14-15-19(28-3)20(16-18)29-4/h5-7,10-11,14-16,21H,8-9,12-13H2,1-4H3,(H,24,25)