4-[2,3-bis(4-methylphenyl)-1,2,3,4-tetrazol-2-ium-5-yl]benzenecarbonitrile

Systemtic Name: 4-[2,3-bis(4-methylphenyl)-1,2,3,4-tetrazol-2-ium-5-yl]benzenecarbonitrile Openeye Name: 4-[2,3-bis(p-tolyl)tetrazol-2-ium-5-yl]benzonitrile CAS Name: 4-[2,3-bis(4-methylphenyl)-5-tetrazol-2-iumyl]benzonitrile IUPAC Name: 4-[2,3-bis(4-methylphenyl)tetrazol-2-ium-5-yl]benzonitrile Traditional Name: 4-[2,3-bis(p-tolyl)tetrazol-2-ium-5-yl]benzonitrile Formula: C22H18N5+ MolecularWeight: 352.41182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2N=C(N=[N+]2C3=CC=C(C=C3)C)C4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=CC=C(C=C1)N2N=C(N=[N+]2C3=CC=C(C=C3)C)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H18N5/c1-16-3-11-20(12-4-16)26-24-22(19-9-7-18(15-23)8-10-19)25-27(26)21-13-5-17(2)6-14-21/h3-14H,1-2H3/q+1