1,3-benzodioxol-5-ylmethyl-[(2R)-1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[(2R)-1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[(1R)-1-methyl-2-oxo-2-(4-sulfamoylanilino)ethyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[(2R)-1-oxo-1-(4-sulfamoylanilino)propan-2-yl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[(2R)-1-oxo-1-(4-sulfamoylanilino)propan-2-yl]azanium Traditional Name: [(1R)-2-keto-1-methyl-2-(4-sulfamoylanilino)ethyl]-piperonyl-ammonium Formula: C17H20N3O5S+ MolecularWeight: 378.4228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)[NH2+]CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)[NH2+]CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H19N3O5S/c1-11(19-9-12-2-7-15-16(8-12)25-10-24-15)17(21)20-13-3-5-14(6-4-13)26(18,22)23/h2-8,11,19H,9-10H2,1H3,(H,20,21)(H2,18,22,23)/p+1/t11-/m1/s1