1-[4-ethylsulfonyl-7-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[4-ethylsulfonyl-7-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]cyclohexane-1-carboxylic acid Openeye Name: 1-(4-ethylsulfonyl-7-methyl-1,3-dioxo-isoindolin-2-yl)cyclohexanecarboxylic acid CAS Name: 1-(4-ethylsulfonyl-7-methyl-1,3-dioxo-2-isoindolyl)-1-cyclohexanecarboxylic acid IUPAC Name: 1-(4-ethylsulfonyl-7-methyl-1,3-dioxoisoindol-2-yl)cyclohexane-1-carboxylic acid Traditional Name: 1-(4-esyl-1,3-diketo-7-methyl-isoindolin-2-yl)cyclohexanecarboxylic acid Formula: C18H21NO6S MolecularWeight: 379.42744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=C2C(=C(C=C1)C)C(=O)N(C2=O)C3(CCCCC3)C(=O)O

Isomeric SMILES

CCS(=O)(=O)C1=C2C(=C(C=C1)C)C(=O)N(C2=O)C3(CCCCC3)C(=O)O

InChI

InChI=1S/C18H21NO6S/c1-3-26(24,25)12-8-7-11(2)13-14(12)16(21)19(15(13)20)18(17(22)23)9-5-4-6-10-18/h7-8H,3-6,9-10H2,1-2H3,(H,22,23)