[2-oxidanylidene-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] 2-chloranylpyridine-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] 2-chloranylpyridine-4-carboxylate Openeye Name: [2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] 2-chloropyridine-4-carboxylate CAS Name: 2-chloro-4-pyridinecarboxylic acid [2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] 2-chloropyridine-4-carboxylate Traditional Name: 2-chloroisonicotinic acid [2-keto-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] ester Formula: C16H16ClN3O5S MolecularWeight: 397.83334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC(=O)COC(=O)C2=CC(=NC=C2)Cl)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1CCNC(=O)COC(=O)C2=CC(=NC=C2)Cl)S(=O)(=O)N

InChI

InChI=1S/C16H16ClN3O5S/c17-14-9-12(6-8-19-14)16(22)25-10-15(21)20-7-5-11-1-3-13(4-2-11)26(18,23)24/h1-4,6,8-9H,5,7,10H2,(H,20,21)(H2,18,23,24)