O2-[2-(1-ethylsulfonyl-2,3-dihydroindol-5-yl)-2-oxidanylidene-ethyl] O4-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-[2-(1-ethylsulfonyl-2,3-dihydroindol-5-yl)-2-oxidanylidene-ethyl] O4-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[2-(1-ethylsulfonylindolin-5-yl)-2-oxo-ethyl] O4-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-(1-ethylsulfonyl-2,3-dihydroindol-5-yl)-2-oxoethyl] ester O4-methyl ester IUPAC Name: 2-O-[2-(1-ethylsulfonyl-2,3-dihydroindol-5-yl)-2-oxoethyl] 4-O-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-(1-esylindolin-5-yl)-2-keto-ethyl] ester O4-methyl ester Formula: C21H24N2O7S MolecularWeight: 448.48946

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC2=C1C=CC(=C2)C(=O)COC(=O)C3=C(C(=C(N3)C)C(=O)OC)C

Isomeric SMILES

CCS(=O)(=O)N1CCC2=C1C=CC(=C2)C(=O)COC(=O)C3=C(C(=C(N3)C)C(=O)OC)C

InChI

InChI=1S/C21H24N2O7S/c1-5-31(27,28)23-9-8-14-10-15(6-7-16(14)23)17(24)11-30-21(26)19-12(2)18(13(3)22-19)20(25)29-4/h6-7,10,22H,5,8-9,11H2,1-4H3