2-[(2-azanyl-3H-indol-1-ium-1-yl)methyl]benzenecarbonitrile

Systemtic Name: 2-[(2-azanyl-3H-indol-1-ium-1-yl)methyl]benzenecarbonitrile Openeye Name: 2-[(2-amino-3H-indol-1-ium-1-yl)methyl]benzonitrile CAS Name: 2-[(2-amino-3H-indol-1-ium-1-yl)methyl]benzonitrile IUPAC Name: 2-[(2-amino-3H-indol-1-ium-1-yl)methyl]benzonitrile Traditional Name: 2-[(2-amino-3H-indol-1-ium-1-yl)methyl]benzonitrile Formula: C16H14N3+ MolecularWeight: 248.30246

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2[N+](=C1N)CC3=CC=CC=C3C#N

Isomeric SMILES

C1C2=CC=CC=C2[N+](=C1N)CC3=CC=CC=C3C#N

InChI

InChI=1S/C16H13N3/c17-10-13-6-1-2-7-14(13)11-19-15-8-4-3-5-12(15)9-16(19)18/h1-8,18H,9,11H2/p+1