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

Systemtic Name: [2-[[(2S)-heptan-2-yl]amino]-2-oxidanylidene-ethyl] 3-(dimethylsulfamoyl)benzoate Openeye Name: [2-[[(1S)-1-methylhexyl]amino]-2-oxo-ethyl] 3-(dimethylsulfamoyl)benzoate CAS Name: 3-(dimethylsulfamoyl)benzoic acid [2-[[(2S)-heptan-2-yl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2S)-heptan-2-yl]amino]-2-oxoethyl] 3-(dimethylsulfamoyl)benzoate Traditional Name: 3-(dimethylsulfamoyl)benzoic acid [2-keto-2-[[(1S)-1-methylhexyl]amino]ethyl] ester Formula: C18H28N2O5S MolecularWeight: 384.49032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28N2O5S/c1-5-6-7-9-14(2)19-17(21)13-25-18(22)15-10-8-11-16(12-15)26(23,24)20(3)4/h8,10-12,14H,5-7,9,13H2,1-4H3,(H,19,21)/t14-/m0/s1