1-(3-methylpyridin-2-yl)-1,4-diazepan-4-ium

Systemtic Name: 1-(3-methylpyridin-2-yl)-1,4-diazepan-4-ium Openeye Name: 1-(3-methyl-2-pyridyl)-1,4-diazepan-4-ium CAS Name: 1-(3-methyl-2-pyridinyl)-1,4-diazepan-4-ium IUPAC Name: 1-(3-methylpyridin-2-yl)-1,4-diazepan-4-ium Traditional Name: 1-(3-methyl-2-pyridyl)-1,4-diazepan-4-ium Formula: C11H18N3+ MolecularWeight: 192.28072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)N2CCC[NH2+]CC2

Isomeric SMILES

CC1=C(N=CC=C1)N2CCC[NH2+]CC2

InChI

InChI=1S/C11H17N3/c1-10-4-2-6-13-11(10)14-8-3-5-12-7-9-14/h2,4,6,12H,3,5,7-9H2,1H3/p+1