(1-cyanoindolizin-2-yl)methyl 4-(oxolan-2-ylmethylsulfamoyl)benzoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 4-(oxolan-2-ylmethylsulfamoyl)benzoate Openeye Name: (1-cyanoindolizin-2-yl)methyl 4-(tetrahydrofuran-2-ylmethylsulfamoyl)benzoate CAS Name: 4-(2-oxolanylmethylsulfamoyl)benzoic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 4-(oxolan-2-ylmethylsulfamoyl)benzoate Traditional Name: 4-(tetrahydrofurfurylsulfamoyl)benzoic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C22H21N3O5S MolecularWeight: 439.48424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNS(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CN4C=CC=CC4=C3C#N

Isomeric SMILES

C1CC(OC1)CNS(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CN4C=CC=CC4=C3C#N

InChI

InChI=1S/C22H21N3O5S/c23-12-20-17(14-25-10-2-1-5-21(20)25)15-30-22(26)16-6-8-19(9-7-16)31(27,28)24-13-18-4-3-11-29-18/h1-2,5-10,14,18,24H,3-4,11,13,15H2