2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-1-ium-3-carbonitrile Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-1-ium-3-carbonitrile CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-1-ium-3-carbonitrile Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-1-ium-3-carbonitrile Formula: C15H14N3+ MolecularWeight: 236.29176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=C(C=CC=[NH+]3)C#N

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=C(C=CC=[NH+]3)C#N

InChI

InChI=1S/C15H13N3/c16-10-13-6-3-8-17-15(13)18-9-7-12-4-1-2-5-14(12)11-18/h1-6,8H,7,9,11H2/p+1