[(2R)-1-[ethyl(phenyl)amino]-1-oxidanylidene-propan-2-yl] 4-chloranyl-3-sulfamoyl-benzoate

Systemtic Name: [(2R)-1-[ethyl(phenyl)amino]-1-oxidanylidene-propan-2-yl] 4-chloranyl-3-sulfamoyl-benzoate Openeye Name: [(1R)-2-(N-ethylanilino)-1-methyl-2-oxo-ethyl] 4-chloro-3-sulfamoyl-benzoate CAS Name: 4-chloro-3-sulfamoylbenzoic acid [(2R)-1-(N-ethylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(N-ethylanilino)-1-oxopropan-2-yl] 4-chloro-3-sulfamoylbenzoate Traditional Name: 4-chloro-3-sulfamoyl-benzoic acid [(1R)-2-(N-ethylanilino)-2-keto-1-methyl-ethyl] ester Formula: C18H19ClN2O5S MolecularWeight: 410.87186

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)C(C)OC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)[C@@H](C)OC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N

InChI

InChI=1S/C18H19ClN2O5S/c1-3-21(14-7-5-4-6-8-14)17(22)12(2)26-18(23)13-9-10-15(19)16(11-13)27(20,24)25/h4-12H,3H2,1-2H3,(H2,20,24,25)/t12-/m1/s1