(1-cyanoindolizin-2-yl)methyl 1-methylsulfonyl-2,3-dihydroindole-5-carboxylate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 1-methylsulfonyl-2,3-dihydroindole-5-carboxylate Openeye Name: (1-cyanoindolizin-2-yl)methyl 1-methylsulfonylindoline-5-carboxylate CAS Name: 1-methylsulfonyl-2,3-dihydroindole-5-carboxylic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 1-methylsulfonyl-2,3-dihydroindole-5-carboxylate Traditional Name: 1-mesylindoline-5-carboxylic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C20H17N3O4S MolecularWeight: 395.43168

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC2=C1C=CC(=C2)C(=O)OCC3=CN4C=CC=CC4=C3C#N

Isomeric SMILES

CS(=O)(=O)N1CCC2=C1C=CC(=C2)C(=O)OCC3=CN4C=CC=CC4=C3C#N

InChI

InChI=1S/C20H17N3O4S/c1-28(25,26)23-9-7-14-10-15(5-6-18(14)23)20(24)27-13-16-12-22-8-3-2-4-19(22)17(16)11-21/h2-6,8,10,12H,7,9,13H2,1H3