(1-cyanoindolizin-2-yl)methyl 2-chloranyl-5-(propan-2-ylsulfamoyl)benzoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 2-chloranyl-5-(propan-2-ylsulfamoyl)benzoate Openeye Name: (1-cyanoindolizin-2-yl)methyl 2-chloro-5-(isopropylsulfamoyl)benzoate CAS Name: 2-chloro-5-(propan-2-ylsulfamoyl)benzoic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 2-chloro-5-(propan-2-ylsulfamoyl)benzoate Traditional Name: 2-chloro-5-(isopropylsulfamoyl)benzoic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C20H18ClN3O4S MolecularWeight: 431.89262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)OCC2=CN3C=CC=CC3=C2C#N

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)OCC2=CN3C=CC=CC3=C2C#N

InChI

InChI=1S/C20H18ClN3O4S/c1-13(2)23-29(26,27)15-6-7-18(21)16(9-15)20(25)28-12-14-11-24-8-4-3-5-19(24)17(14)10-22/h3-9,11,13,23H,12H2,1-2H3