[1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]butan-2-yl] 2-chloranylpyridine-4-carboxylate

Systemtic Name: [1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]butan-2-yl] 2-chloranylpyridine-4-carboxylate Openeye Name: 1-[(4-sulfamoylphenyl)carbamoyl]propyl 2-chloropyridine-4-carboxylate CAS Name: 2-chloro-4-pyridinecarboxylic acid [1-oxo-1-(4-sulfamoylanilino)butan-2-yl] ester IUPAC Name: [1-oxo-1-(4-sulfamoylanilino)butan-2-yl] 2-chloropyridine-4-carboxylate Traditional Name: 2-chloroisonicotinic acid 1-[(4-sulfamoylphenyl)carbamoyl]propyl ester Formula: C16H16ClN3O5S MolecularWeight: 397.83334

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)OC(=O)C2=CC(=NC=C2)Cl

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)OC(=O)C2=CC(=NC=C2)Cl

InChI

InChI=1S/C16H16ClN3O5S/c1-2-13(25-16(22)10-7-8-19-14(17)9-10)15(21)20-11-3-5-12(6-4-11)26(18,23)24/h3-9,13H,2H2,1H3,(H,20,21)(H2,18,23,24)