[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl] 1-(3,4-dimethylphenyl)sulfonylcyclopentane-1-carboxylate

Systemtic Name: [2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl] 1-(3,4-dimethylphenyl)sulfonylcyclopentane-1-carboxylate Openeye Name: [2-(2-methylindolin-1-yl)-2-oxo-ethyl] 1-(3,4-dimethylphenyl)sulfonylcyclopentanecarboxylate CAS Name: 1-(3,4-dimethylphenyl)sulfonyl-1-cyclopentanecarboxylic acid [2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl] ester IUPAC Name: [2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl] 1-(3,4-dimethylphenyl)sulfonylcyclopentane-1-carboxylate Traditional Name: 1-(3,4-dimethylphenyl)sulfonylcyclopentanecarboxylic acid [2-keto-2-(2-methylindolin-1-yl)ethyl] ester Formula: C25H29NO5S MolecularWeight: 455.56646

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)COC(=O)C3(CCCC3)S(=O)(=O)C4=CC(=C(C=C4)C)C

Isomeric SMILES

CC1CC2=CC=CC=C2N1C(=O)COC(=O)C3(CCCC3)S(=O)(=O)C4=CC(=C(C=C4)C)C

InChI

InChI=1S/C25H29NO5S/c1-17-10-11-21(14-18(17)2)32(29,30)25(12-6-7-13-25)24(28)31-16-23(27)26-19(3)15-20-8-4-5-9-22(20)26/h4-5,8-11,14,19H,6-7,12-13,15-16H2,1-3H3