(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)methyl-(3-morpholin-4-ium-4-ylpropyl)azanium

Systemtic Name: (1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Openeye Name: (1,3-dimethyl-2-oxo-benzimidazol-5-yl)methyl-(3-morpholin-4-ium-4-ylpropyl)ammonium CAS Name: (1,3-dimethyl-2-oxo-5-benzimidazolyl)methyl-[3-(4-morpholin-4-iumyl)propyl]ammonium IUPAC Name: (1,3-dimethyl-2-oxobenzimidazol-5-yl)methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Traditional Name: (2-keto-1,3-dimethyl-benzimidazol-5-yl)methyl-(3-morpholin-4-ium-4-ylpropyl)ammonium Formula: C17H28N4O2+2 MolecularWeight: 320.42982

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C[NH2+]CCC[NH+]3CCOCC3)N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)C[NH2+]CCC[NH+]3CCOCC3)N(C1=O)C

InChI

InChI=1S/C17H26N4O2/c1-19-15-5-4-14(12-16(15)20(2)17(19)22)13-18-6-3-7-21-8-10-23-11-9-21/h4-5,12,18H,3,6-11,13H2,1-2H3/p+2