4-phenylazanyl-2-[(phenylmethyl)amino]pyridin-1-ium-3,5-dicarbonitrile

Systemtic Name: 4-phenylazanyl-2-[(phenylmethyl)amino]pyridin-1-ium-3,5-dicarbonitrile Openeye Name: 4-anilino-2-(benzylamino)pyridin-1-ium-3,5-dicarbonitrile CAS Name: 4-anilino-2-[(phenylmethyl)amino]pyridin-1-ium-3,5-dicarbonitrile IUPAC Name: 4-anilino-2-(benzylamino)pyridin-1-ium-3,5-dicarbonitrile Traditional Name: 4-anilino-2-(benzylamino)pyridin-1-ium-3,5-dicarbonitrile Formula: C20H16N5+ MolecularWeight: 326.37454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=[NH+]C=C(C(=C2C#N)NC3=CC=CC=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)CNC2=[NH+]C=C(C(=C2C#N)NC3=CC=CC=C3)C#N

InChI

InChI=1S/C20H15N5/c21-11-16-14-24-20(23-13-15-7-3-1-4-8-15)18(12-22)19(16)25-17-9-5-2-6-10-17/h1-10,14H,13H2,(H2,23,24,25)/p+1