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

Systemtic Name: 1-(3-chloranylpyridin-1-ium-2-yl)-1,4-diazepan-4-ium Openeye Name: 1-(3-chloropyridin-1-ium-2-yl)-1,4-diazepan-4-ium CAS Name: 1-(3-chloro-2-pyridin-1-iumyl)-1,4-diazepan-4-ium IUPAC Name: 1-(3-chloropyridin-1-ium-2-yl)-1,4-diazepan-4-ium Traditional Name: 1-(3-chloropyridin-1-ium-2-yl)-1,4-diazepan-4-ium Formula: C10H16ClN3+2 MolecularWeight: 213.70714

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCN(C1)C2=C(C=CC=[NH+]2)Cl

Isomeric SMILES

C1C[NH2+]CCN(C1)C2=C(C=CC=[NH+]2)Cl

InChI

InChI=1S/C10H14ClN3/c11-9-3-1-5-13-10(9)14-7-2-4-12-6-8-14/h1,3,5,12H,2,4,6-8H2/p+2