3-[(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)methylazaniumyl]propyl-diethyl-azanium

Systemtic Name: 3-[(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)methylazaniumyl]propyl-diethyl-azanium Openeye Name: 3-[(1,3-dimethyl-2-oxo-benzimidazol-5-yl)methylammonio]propyl-diethyl-ammonium CAS Name: 3-[(1,3-dimethyl-2-oxo-5-benzimidazolyl)methylammonio]propyl-diethylammonium IUPAC Name: 3-[(1,3-dimethyl-2-oxobenzimidazol-5-yl)methylazaniumyl]propyl-diethylazanium Traditional Name: diethyl-[3-[(2-keto-1,3-dimethyl-benzimidazol-5-yl)methylammonio]propyl]ammonium Formula: C17H30N4O+2 MolecularWeight: 306.4463

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCC[NH2+]CC1=CC2=C(C=C1)N(C(=O)N2C)C

Isomeric SMILES

CC[NH+](CC)CCC[NH2+]CC1=CC2=C(C=C1)N(C(=O)N2C)C

InChI

InChI=1S/C17H28N4O/c1-5-21(6-2)11-7-10-18-13-14-8-9-15-16(12-14)20(4)17(22)19(15)3/h8-9,12,18H,5-7,10-11,13H2,1-4H3/p+2