[(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] 3-(1,3-benzodioxol-5-ylsulfamoyl)benzoate

Systemtic Name: [(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] 3-(1,3-benzodioxol-5-ylsulfamoyl)benzoate Openeye Name: [(1R)-2-amino-1-methyl-2-oxo-ethyl] 3-(1,3-benzodioxol-5-ylsulfamoyl)benzoate CAS Name: 3-(1,3-benzodioxol-5-ylsulfamoyl)benzoic acid [(2R)-1-amino-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-amino-1-oxopropan-2-yl] 3-(1,3-benzodioxol-5-ylsulfamoyl)benzoate Traditional Name: 3-(1,3-benzodioxol-5-ylsulfamoyl)benzoic acid [(1R)-2-amino-2-keto-1-methyl-ethyl] ester Formula: C17H16N2O7S MolecularWeight: 392.38314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)C1=CC(=CC=C1)S(=O)(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[C@H](C(=O)N)OC(=O)C1=CC(=CC=C1)S(=O)(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H16N2O7S/c1-10(16(18)20)26-17(21)11-3-2-4-13(7-11)27(22,23)19-12-5-6-14-15(8-12)25-9-24-14/h2-8,10,19H,9H2,1H3,(H2,18,20)/t10-/m1/s1