1,3-diphenyl-2H-quinazolin-3-ium-8-carbonitrile

Systemtic Name: 1,3-diphenyl-2H-quinazolin-3-ium-8-carbonitrile Openeye Name: 1,3-diphenyl-2H-quinazolin-3-ium-8-carbonitrile CAS Name: 1,3-diphenyl-2H-quinazolin-3-ium-8-carbonitrile IUPAC Name: 1,3-diphenyl-2H-quinazolin-3-ium-8-carbonitrile Traditional Name: 1,3-diphenyl-2H-quinazolin-3-ium-8-carbonitrile Formula: C21H16N3+ MolecularWeight: 310.37184

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Descriptors Computed from Structure

Canonical SMILES:

C1N(C2=C(C=CC=C2C=[N+]1C3=CC=CC=C3)C#N)C4=CC=CC=C4

Isomeric SMILES

C1N(C2=C(C=CC=C2C=[N+]1C3=CC=CC=C3)C#N)C4=CC=CC=C4

InChI

InChI=1S/C21H16N3/c22-14-17-8-7-9-18-15-23(19-10-3-1-4-11-19)16-24(21(17)18)20-12-5-2-6-13-20/h1-13,15H,16H2/q+1