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

Systemtic Name: [(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] 3-(1,3-benzodioxol-5-ylmethylsulfamoyl)benzoate Openeye Name: [(1R)-2-amino-1-methyl-2-oxo-ethyl] 3-(1,3-benzodioxol-5-ylmethylsulfamoyl)benzoate CAS Name: 3-(1,3-benzodioxol-5-ylmethylsulfamoyl)benzoic acid [(2R)-1-amino-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-amino-1-oxopropan-2-yl] 3-(1,3-benzodioxol-5-ylmethylsulfamoyl)benzoate Traditional Name: 3-(piperonylsulfamoyl)benzoic acid [(1R)-2-amino-2-keto-1-methyl-ethyl] ester Formula: C18H18N2O7S MolecularWeight: 406.40972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)C1=CC(=CC=C1)S(=O)(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[C@H](C(=O)N)OC(=O)C1=CC(=CC=C1)S(=O)(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H18N2O7S/c1-11(17(19)21)27-18(22)13-3-2-4-14(8-13)28(23,24)20-9-12-5-6-15-16(7-12)26-10-25-15/h2-8,11,20H,9-10H2,1H3,(H2,19,21)/t11-/m1/s1