[2-[(2R)-2-methyl-1-methylsulfonyl-2,3-dihydroindol-5-yl]-2-oxidanylidene-ethyl] 4-ethoxybenzoate

Systemtic Name: [2-[(2R)-2-methyl-1-methylsulfonyl-2,3-dihydroindol-5-yl]-2-oxidanylidene-ethyl] 4-ethoxybenzoate Openeye Name: [2-[(2R)-2-methyl-1-methylsulfonyl-indolin-5-yl]-2-oxo-ethyl] 4-ethoxybenzoate CAS Name: 4-ethoxybenzoic acid [2-[(2R)-2-methyl-1-methylsulfonyl-2,3-dihydroindol-5-yl]-2-oxoethyl] ester IUPAC Name: [2-[(2R)-2-methyl-1-methylsulfonyl-2,3-dihydroindol-5-yl]-2-oxoethyl] 4-ethoxybenzoate Traditional Name: 4-ethoxybenzoic acid [2-keto-2-[(2R)-1-mesyl-2-methyl-indolin-5-yl]ethyl] ester Formula: C21H23NO6S MolecularWeight: 417.47542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)OCC(=O)C2=CC3=C(C=C2)N(C(C3)C)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)OCC(=O)C2=CC3=C(C=C2)N([C@@H](C3)C)S(=O)(=O)C

InChI

InChI=1S/C21H23NO6S/c1-4-27-18-8-5-15(6-9-18)21(24)28-13-20(23)16-7-10-19-17(12-16)11-14(2)22(19)29(3,25)26/h5-10,12,14H,4,11,13H2,1-3H3/t14-/m1/s1