methyl 1-[3,3-bis(phenylsulfonyl)butyl]-2-oxidanylidene-cyclopentane-1-carboxylate

Systemtic Name: methyl 1-[3,3-bis(phenylsulfonyl)butyl]-2-oxidanylidene-cyclopentane-1-carboxylate Openeye Name: methyl 1-[3,3-bis(benzenesulfonyl)butyl]-2-oxo-cyclopentanecarboxylate CAS Name: 1-[3,3-bis(benzenesulfonyl)butyl]-2-oxo-1-cyclopentanecarboxylic acid methyl ester IUPAC Name: methyl 1-[3,3-bis(benzenesulfonyl)butyl]-2-oxocyclopentane-1-carboxylate Traditional Name: 1-(3,3-dibesylbutyl)-2-keto-cyclopentanecarboxylic acid methyl ester Formula: C23H26O7S2 MolecularWeight: 478.57834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1(CCCC1=O)C(=O)OC)(S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(CCC1(CCCC1=O)C(=O)OC)(S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H26O7S2/c1-22(31(26,27)18-10-5-3-6-11-18,32(28,29)19-12-7-4-8-13-19)16-17-23(21(25)30-2)15-9-14-20(23)24/h3-8,10-13H,9,14-17H2,1-2H3