[2-[(3R)-3-methyl-2-oxidanylidene-1,3-dihydroindol-5-yl]-2-oxidanylidene-ethyl] 2-ethylsulfonylbenzoate

Systemtic Name: [2-[(3R)-3-methyl-2-oxidanylidene-1,3-dihydroindol-5-yl]-2-oxidanylidene-ethyl] 2-ethylsulfonylbenzoate Openeye Name: [2-[(3R)-3-methyl-2-oxo-indolin-5-yl]-2-oxo-ethyl] 2-ethylsulfonylbenzoate CAS Name: 2-ethylsulfonylbenzoic acid [2-[(3R)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-2-oxoethyl] ester IUPAC Name: [2-[(3R)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-2-oxoethyl] 2-ethylsulfonylbenzoate Traditional Name: 2-esylbenzoic acid [2-keto-2-[(3R)-2-keto-3-methyl-indolin-5-yl]ethyl] ester Formula: C20H19NO6S MolecularWeight: 401.43296

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=CC=C1C(=O)OCC(=O)C2=CC3=C(C=C2)NC(=O)C3C

Isomeric SMILES

CCS(=O)(=O)C1=CC=CC=C1C(=O)OCC(=O)C2=CC3=C(C=C2)NC(=O)[C@@H]3C

InChI

InChI=1S/C20H19NO6S/c1-3-28(25,26)18-7-5-4-6-14(18)20(24)27-11-17(22)13-8-9-16-15(10-13)12(2)19(23)21-16/h4-10,12H,3,11H2,1-2H3,(H,21,23)/t12-/m1/s1