4-(1,6-dimethyl-1-phenyl-2H-quinazoline-1,3-diium-3-yl)benzenecarbonitrile

Systemtic Name: 4-(1,6-dimethyl-1-phenyl-2H-quinazoline-1,3-diium-3-yl)benzenecarbonitrile Openeye Name: 4-(1,6-dimethyl-1-phenyl-2H-quinazoline-1,3-diium-3-yl)benzonitrile CAS Name: 4-(1,6-dimethyl-1-phenyl-2H-quinazoline-1,3-diium-3-yl)benzonitrile IUPAC Name: 4-(1,6-dimethyl-1-phenyl-2H-quinazoline-1,3-diium-3-yl)benzonitrile Traditional Name: 4-(1,6-dimethyl-1-phenyl-2H-quinazoline-1,3-diium-3-yl)benzonitrile Formula: C23H21N3+2 MolecularWeight: 339.43294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)[N+](C[N+](=C2)C3=CC=C(C=C3)C#N)(C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)[N+](C[N+](=C2)C3=CC=C(C=C3)C#N)(C)C4=CC=CC=C4

InChI

InChI=1S/C23H21N3/c1-18-8-13-23-20(14-18)16-25(21-11-9-19(15-24)10-12-21)17-26(23,2)22-6-4-3-5-7-22/h3-14,16H,17H2,1-2H3/q+2