[2-[[(2S)-butan-2-yl]amino]-2-oxidanylidene-ethyl] 4-chloranyl-3-(cyclopropylsulfamoyl)benzoate

Systemtic Name: [2-[[(2S)-butan-2-yl]amino]-2-oxidanylidene-ethyl] 4-chloranyl-3-(cyclopropylsulfamoyl)benzoate Openeye Name: [2-[[(1S)-1-methylpropyl]amino]-2-oxo-ethyl] 4-chloro-3-(cyclopropylsulfamoyl)benzoate CAS Name: 4-chloro-3-(cyclopropylsulfamoyl)benzoic acid [2-[[(2S)-butan-2-yl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2S)-butan-2-yl]amino]-2-oxoethyl] 4-chloro-3-(cyclopropylsulfamoyl)benzoate Traditional Name: 4-chloro-3-(cyclopropylsulfamoyl)benzoic acid [2-keto-2-[[(1S)-1-methylpropyl]amino]ethyl] ester Formula: C16H21ClN2O5S MolecularWeight: 388.86634

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)NC2CC2

Isomeric SMILES

CC[C@H](C)NC(=O)COC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)NC2CC2

InChI

InChI=1S/C16H21ClN2O5S/c1-3-10(2)18-15(20)9-24-16(21)11-4-7-13(17)14(8-11)25(22,23)19-12-5-6-12/h4,7-8,10,12,19H,3,5-6,9H2,1-2H3,(H,18,20)/t10-/m0/s1