3-[[2-(cycloheptylamino)pyridin-1-ium-3-yl]carbonylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[2-(cycloheptylamino)pyridin-1-ium-3-yl]carbonylamino]propyl-dimethyl-azanium Openeye Name: 3-[[2-(cycloheptylamino)pyridin-1-ium-3-carbonyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[2-(cycloheptylamino)-3-pyridin-1-iumyl]-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[2-(cycloheptylamino)pyridin-1-ium-3-carbonyl]amino]propyl-dimethylazanium Traditional Name: 3-[[2-(cycloheptylamino)pyridin-1-ium-3-carbonyl]amino]propyl-dimethyl-ammonium Formula: C18H32N4O+2 MolecularWeight: 320.47288

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=O)C1=C([NH+]=CC=C1)NC2CCCCCC2

Isomeric SMILES

C[NH+](C)CCCNC(=O)C1=C([NH+]=CC=C1)NC2CCCCCC2

InChI

InChI=1S/C18H30N4O/c1-22(2)14-8-13-20-18(23)16-11-7-12-19-17(16)21-15-9-5-3-4-6-10-15/h7,11-12,15H,3-6,8-10,13-14H2,1-2H3,(H,19,21)(H,20,23)/p+2