[2-oxidanylidene-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] 2-azanyl-4-chloranyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] 2-azanyl-4-chloranyl-benzoate Openeye Name: [2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] 2-amino-4-chloro-benzoate CAS Name: 2-amino-4-chlorobenzoic acid [2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] 2-amino-4-chlorobenzoate Traditional Name: 2-amino-4-chloro-benzoic acid [2-keto-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] ester Formula: C17H18ClN3O5S MolecularWeight: 411.85992

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18ClN3O5S/c18-12-3-6-14(15(19)9-12)17(23)26-10-16(22)21-8-7-11-1-4-13(5-2-11)27(20,24)25/h1-6,9H,7-8,10,19H2,(H,21,22)(H2,20,24,25)