[1-[(4-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(oxolan-2-ylmethylsulfamoyl)benzoate

Systemtic Name: [1-[(4-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(oxolan-2-ylmethylsulfamoyl)benzoate Openeye Name: [2-(4-cyanoanilino)-1-methyl-2-oxo-ethyl] 3-(tetrahydrofuran-2-ylmethylsulfamoyl)benzoate CAS Name: 3-(2-oxolanylmethylsulfamoyl)benzoic acid [1-(4-cyanoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-cyanoanilino)-1-oxopropan-2-yl] 3-(oxolan-2-ylmethylsulfamoyl)benzoate Traditional Name: 3-(tetrahydrofurfurylsulfamoyl)benzoic acid [2-(4-cyanoanilino)-2-keto-1-methyl-ethyl] ester Formula: C22H23N3O6S MolecularWeight: 457.49952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C#N)OC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3CCCO3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C#N)OC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3CCCO3

InChI

InChI=1S/C22H23N3O6S/c1-15(21(26)25-18-9-7-16(13-23)8-10-18)31-22(27)17-4-2-6-20(12-17)32(28,29)24-14-19-5-3-11-30-19/h2,4,6-10,12,15,19,24H,3,5,11,14H2,1H3,(H,25,26)