1,3-benzodioxol-5-ylmethyl-[(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)methyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)methyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[(1,3-dimethyl-2-oxo-benzimidazol-5-yl)methyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[(1,3-dimethyl-2-oxo-5-benzimidazolyl)methyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[(1,3-dimethyl-2-oxobenzimidazol-5-yl)methyl]azanium Traditional Name: (2-keto-1,3-dimethyl-benzimidazol-5-yl)methyl-piperonyl-ammonium Formula: C18H20N3O3+ MolecularWeight: 326.3697

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C[NH2+]CC3=CC4=C(C=C3)OCO4)N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)C[NH2+]CC3=CC4=C(C=C3)OCO4)N(C1=O)C

InChI

InChI=1S/C18H19N3O3/c1-20-14-5-3-12(7-15(14)21(2)18(20)22)9-19-10-13-4-6-16-17(8-13)24-11-23-16/h3-8,19H,9-11H2,1-2H3/p+1