3-[(2-aminophenyl)methyl]-1-methyl-pyridin-1-ium-4-carbonitrile

Systemtic Name: 3-[(2-aminophenyl)methyl]-1-methyl-pyridin-1-ium-4-carbonitrile Openeye Name: 3-[(2-aminophenyl)methyl]-1-methyl-pyridin-1-ium-4-carbonitrile CAS Name: 3-[(2-aminophenyl)methyl]-1-methyl-4-pyridin-1-iumcarbonitrile IUPAC Name: 3-[(2-aminophenyl)methyl]-1-methylpyridin-1-ium-4-carbonitrile Traditional Name: 3-(2-aminobenzyl)-1-methyl-pyridin-1-ium-4-carbonitrile Formula: C14H14N3+ MolecularWeight: 224.28106

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC(=C(C=C1)C#N)CC2=CC=CC=C2N

Isomeric SMILES

C[N+]1=CC(=C(C=C1)C#N)CC2=CC=CC=C2N

InChI

InChI=1S/C14H14N3/c1-17-7-6-12(9-15)13(10-17)8-11-4-2-3-5-14(11)16/h2-7,10H,8,16H2,1H3/q+1