4-(4-methyl-1,4-diazepan-4-ium-1-yl)pyridin-1-ium-3-amine

Systemtic Name: 4-(4-methyl-1,4-diazepan-4-ium-1-yl)pyridin-1-ium-3-amine Openeye Name: 4-(4-methyl-1,4-diazepan-4-ium-1-yl)pyridin-1-ium-3-amine CAS Name: 4-(4-methyl-1,4-diazepan-4-ium-1-yl)-3-pyridin-1-iumamine IUPAC Name: 4-(4-methyl-1,4-diazepan-4-ium-1-yl)pyridin-1-ium-3-amine Traditional Name: [4-(4-methyl-1,4-diazepan-4-ium-1-yl)pyridin-1-ium-3-yl]amine Formula: C11H20N4+2 MolecularWeight: 208.3033

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C2=C(C=[NH+]C=C2)N

Isomeric SMILES

C[NH+]1CCCN(CC1)C2=C(C=[NH+]C=C2)N

InChI

InChI=1S/C11H18N4/c1-14-5-2-6-15(8-7-14)11-3-4-13-9-10(11)12/h3-4,9H,2,5-8,12H2,1H3/p+2