[2-[bis[(2R)-butan-2-yl]amino]-2-oxidanylidene-ethyl] 3-(methylsulfamoyl)benzoate

Systemtic Name: [2-[bis[(2R)-butan-2-yl]amino]-2-oxidanylidene-ethyl] 3-(methylsulfamoyl)benzoate Openeye Name: [2-[bis[(1R)-1-methylpropyl]amino]-2-oxo-ethyl] 3-(methylsulfamoyl)benzoate CAS Name: 3-(methylsulfamoyl)benzoic acid [2-[bis[(2R)-butan-2-yl]amino]-2-oxoethyl] ester IUPAC Name: [2-[bis[(2R)-butan-2-yl]amino]-2-oxoethyl] 3-(methylsulfamoyl)benzoate Traditional Name: 3-(methylsulfamoyl)benzoic acid [2-[bis[(1R)-1-methylpropyl]amino]-2-keto-ethyl] ester Formula: C18H28N2O5S MolecularWeight: 384.49032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28N2O5S/c1-6-13(3)20(14(4)7-2)17(21)12-25-18(22)15-9-8-10-16(11-15)26(23,24)19-5/h8-11,13-14,19H,6-7,12H2,1-5H3/t13-,14-/m1/s1