cyanomethyl 4-(butylaminosulfamoyl)-3-phenoxy-benzoate

Systemtic Name: cyanomethyl 4-(butylaminosulfamoyl)-3-phenoxy-benzoate Openeye Name: cyanomethyl 4-(butylaminosulfamoyl)-3-phenoxy-benzoate CAS Name: 4-(butylaminosulfamoyl)-3-phenoxybenzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 4-(butylaminosulfamoyl)-3-phenoxybenzoate Traditional Name: 4-(butylaminosulfamoyl)-3-phenoxy-benzoic acid cyanomethyl ester Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNNS(=O)(=O)C1=C(C=C(C=C1)C(=O)OCC#N)OC2=CC=CC=C2

Isomeric SMILES

CCCCNNS(=O)(=O)C1=C(C=C(C=C1)C(=O)OCC#N)OC2=CC=CC=C2

InChI

InChI=1S/C19H21N3O5S/c1-2-3-12-21-22-28(24,25)18-10-9-15(19(23)26-13-11-20)14-17(18)27-16-7-5-4-6-8-16/h4-10,14,21-22H,2-3,12-13H2,1H3