2-(2-quinolin-8-ylethylamino)pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-(2-quinolin-8-ylethylamino)pyridin-1-ium-3-carbonitrile Openeye Name: 2-[2-(8-quinolyl)ethylamino]pyridin-1-ium-3-carbonitrile CAS Name: 2-[2-(8-quinolinyl)ethylamino]-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-(2-quinolin-8-ylethylamino)pyridin-1-ium-3-carbonitrile Traditional Name: 2-[2-(8-quinolyl)ethylamino]pyridin-1-ium-3-carbonitrile Formula: C17H15N4+ MolecularWeight: 275.3278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)CCNC3=C(C=CC=[NH+]3)C#N)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)CCNC3=C(C=CC=[NH+]3)C#N)N=CC=C2

InChI

InChI=1S/C17H14N4/c18-12-15-7-3-10-20-17(15)21-11-8-14-5-1-4-13-6-2-9-19-16(13)14/h1-7,9-10H,8,11H2,(H,20,21)/p+1