1-(2-pyridin-2-ylethyl)-1,4-diazepane-1,4-diium

Systemtic Name: 1-(2-pyridin-2-ylethyl)-1,4-diazepane-1,4-diium Openeye Name: 1-[2-(2-pyridyl)ethyl]-1,4-diazepane-1,4-diium CAS Name: 1-[2-(2-pyridinyl)ethyl]-1,4-diazepane-1,4-diium IUPAC Name: 1-(2-pyridin-2-ylethyl)-1,4-diazepane-1,4-diium Traditional Name: 1-[2-(2-pyridyl)ethyl]-1,4-diazepane-1,4-diium Formula: C12H21N3+2 MolecularWeight: 207.31524

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CC[NH+](C1)CCC2=CC=CC=N2

Isomeric SMILES

C1C[NH2+]CC[NH+](C1)CCC2=CC=CC=N2

InChI

InChI=1S/C12H19N3/c1-2-7-14-12(4-1)5-10-15-9-3-6-13-8-11-15/h1-2,4,7,13H,3,5-6,8-11H2/p+2