methyl 3-[[1-(3,4-dimethylphenyl)sulfonylcyclopentyl]carbonyloxymethyl]benzoate

Systemtic Name: methyl 3-[[1-(3,4-dimethylphenyl)sulfonylcyclopentyl]carbonyloxymethyl]benzoate Openeye Name: methyl 3-[[1-(3,4-dimethylphenyl)sulfonylcyclopentanecarbonyl]oxymethyl]benzoate CAS Name: 3-[[[1-(3,4-dimethylphenyl)sulfonylcyclopentyl]-oxomethoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[1-(3,4-dimethylphenyl)sulfonylcyclopentanecarbonyl]oxymethyl]benzoate Traditional Name: 3-[[1-(3,4-dimethylphenyl)sulfonylcyclopentanecarbonyl]oxymethyl]benzoic acid methyl ester Formula: C23H26O6S MolecularWeight: 430.51394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C2(CCCC2)C(=O)OCC3=CC=CC(=C3)C(=O)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C2(CCCC2)C(=O)OCC3=CC=CC(=C3)C(=O)OC)C

InChI

InChI=1S/C23H26O6S/c1-16-9-10-20(13-17(16)2)30(26,27)23(11-4-5-12-23)22(25)29-15-18-7-6-8-19(14-18)21(24)28-3/h6-10,13-14H,4-5,11-12,15H2,1-3H3