3-[(3-methylpyrazin-1-ium-1-yl)methyl]benzenecarbonitrile

Systemtic Name: 3-[(3-methylpyrazin-1-ium-1-yl)methyl]benzenecarbonitrile Openeye Name: 3-[(3-methylpyrazin-1-ium-1-yl)methyl]benzonitrile CAS Name: 3-[(3-methyl-1-pyrazin-1-iumyl)methyl]benzonitrile IUPAC Name: 3-[(3-methylpyrazin-1-ium-1-yl)methyl]benzonitrile Traditional Name: 3-[(3-methylpyrazin-1-ium-1-yl)methyl]benzonitrile Formula: C13H12N3+ MolecularWeight: 210.25448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C[N+](=C1)CC2=CC=CC(=C2)C#N

Isomeric SMILES

CC1=NC=C[N+](=C1)CC2=CC=CC(=C2)C#N

InChI

InChI=1S/C13H12N3/c1-11-9-16(6-5-15-11)10-13-4-2-3-12(7-13)8-14/h2-7,9H,10H2,1H3/q+1