3-azanylidene-2-(1,3-diphenyl-1,2,3,4-tetrazol-1-ium-5-yl)prop-2-enenitrile

Systemtic Name: 3-azanylidene-2-(1,3-diphenyl-1,2,3,4-tetrazol-1-ium-5-yl)prop-2-enenitrile Openeye Name: 2-(1,3-diphenyltetrazol-1-ium-5-yl)-3-imino-prop-2-enenitrile CAS Name: 2-(1,3-diphenyl-5-tetrazol-1-iumyl)-3-imino-2-propenenitrile IUPAC Name: 2-(1,3-diphenyltetrazol-1-ium-5-yl)-3-iminoprop-2-enenitrile Traditional Name: 2-(1,3-diphenyltetrazol-1-ium-5-yl)-3-imino-acrylonitrile Formula: C16H11N6+ MolecularWeight: 287.29874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2N=C([N+](=N2)C3=CC=CC=C3)C(=C=N)C#N

Isomeric SMILES

C1=CC=C(C=C1)N2N=C([N+](=N2)C3=CC=CC=C3)C(=C=N)C#N

InChI

InChI=1S/C16H11N6/c17-11-13(12-18)16-19-22(15-9-5-2-6-10-15)20-21(16)14-7-3-1-4-8-14/h1-10,17H/q+1