[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-chloranyl-5-sulfamoyl-benzoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-chloranyl-5-sulfamoyl-benzoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 2-chloro-5-sulfamoyl-benzoate CAS Name: 2-chloro-5-sulfamoylbenzoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 2-chloro-5-sulfamoylbenzoate Traditional Name: 2-chloro-5-sulfamoyl-benzoic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C14H19ClN2O5S MolecularWeight: 362.82906

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N)Cl

Isomeric SMILES

CCC(CC)NC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N)Cl

InChI

InChI=1S/C14H19ClN2O5S/c1-3-9(4-2)17-13(18)8-22-14(19)11-7-10(23(16,20)21)5-6-12(11)15/h5-7,9H,3-4,8H2,1-2H3,(H,17,18)(H2,16,20,21)