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2-[3-(pyridin-1-ium-2-ylamino)propylamino]pyridine-3-carbonitrile

2-[3-(pyridin-1-ium-2-ylamino)propylamino]pyridine-3-carbonitrile

Systemtic Name:2-[3-(pyridin-1-ium-2-ylamino)propylamino]pyridine-3-carbonitrile
Openeye Name:2-[3-(pyridin-1-ium-2-ylamino)propylamino]pyridine-3-carbonitrile
CAS Name:2-[3-(2-pyridin-1-iumylamino)propylamino]-3-pyridinecarbonitrile
IUPAC Name:2-[3-(pyridin-1-ium-2-ylamino)propylamino]pyridine-3-carbonitrile
Traditional Name:2-[3-(pyridin-1-ium-2-ylamino)propylamino]nicotinonitrile
Formula: C14H16N5+
MolecularWeight: 254.31034
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[NH+]C(=C1)NCCCNC2=C(C=CC=N2)C#N


Isomeric SMILES

C1=CC=[NH+]C(=C1)NCCCNC2=C(C=CC=N2)C#N


InChI

InChI=1S/C14H15N5/c15-11-12-5-3-8-18-14(12)19-10-4-9-17-13-6-1-2-7-16-13/h1-3,5-8H,4,9-10H2,(H,16,17)(H,18,19)/p+1


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