[2-[[(2S)-heptan-2-yl]amino]-2-oxidanylidene-ethyl] 3-(methylsulfamoyl)benzoate

Systemtic Name: [2-[[(2S)-heptan-2-yl]amino]-2-oxidanylidene-ethyl] 3-(methylsulfamoyl)benzoate Openeye Name: [2-[[(1S)-1-methylhexyl]amino]-2-oxo-ethyl] 3-(methylsulfamoyl)benzoate CAS Name: 3-(methylsulfamoyl)benzoic acid [2-[[(2S)-heptan-2-yl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2S)-heptan-2-yl]amino]-2-oxoethyl] 3-(methylsulfamoyl)benzoate Traditional Name: 3-(methylsulfamoyl)benzoic acid [2-keto-2-[[(1S)-1-methylhexyl]amino]ethyl] ester Formula: C17H26N2O5S MolecularWeight: 370.46374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)COC(=O)C1=CC(=CC=C1)S(=O)(=O)NC

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2O5S/c1-4-5-6-8-13(2)19-16(20)12-24-17(21)14-9-7-10-15(11-14)25(22,23)18-3/h7,9-11,13,18H,4-6,8,12H2,1-3H3,(H,19,20)/t13-/m0/s1