4-(2,3-diphenyl-1,3-dihydro-1,2,3,4-tetrazol-3-ium-5-yl)benzenecarbonitrile chloride

Systemtic Name: 4-(2,3-diphenyl-1,3-dihydro-1,2,3,4-tetrazol-3-ium-5-yl)benzenecarbonitrile chloride Openeye Name: 4-(2,3-diphenyl-1,3-dihydrotetrazol-3-ium-5-yl)benzonitrile chloride CAS Name: 4-(2,3-diphenyl-1,3-dihydrotetrazol-3-ium-5-yl)benzonitrile chloride IUPAC Name: 4-(2,3-diphenyl-1,3-dihydrotetrazol-3-ium-5-yl)benzonitrile chloride Traditional Name: 4-(2,3-diphenyl-1,3-dihydrotetrazol-3-ium-5-yl)benzonitrile chloride Formula: C20H16ClN5 MolecularWeight: 361.82754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[NH+]2N=C(NN2C3=CC=CC=C3)C4=CC=C(C=C4)C#N.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)[NH+]2N=C(NN2C3=CC=CC=C3)C4=CC=C(C=C4)C#N.[Cl-]

InChI

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