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

Systemtic Name: 1-[(4-nitrophenyl)methyl]pyridin-1-ium-3-carbonitrile Openeye Name: 1-[(4-nitrophenyl)methyl]pyridin-1-ium-3-carbonitrile CAS Name: 1-[(4-nitrophenyl)methyl]-3-pyridin-1-iumcarbonitrile IUPAC Name: 1-[(4-nitrophenyl)methyl]pyridin-1-ium-3-carbonitrile Traditional Name: 1-(4-nitrobenzyl)pyridin-1-ium-3-carbonitrile Formula: C13H10N3O2+ MolecularWeight: 240.2374

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[N+](=C1)CC2=CC=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC(=C[N+](=C1)CC2=CC=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C13H10N3O2/c14-8-12-2-1-7-15(10-12)9-11-3-5-13(6-4-11)16(17)18/h1-7,10H,9H2/q+1