4-(10b,10c-dimethylpyren-2-yl)benzenecarbonitrile

Systemtic Name: 4-(10b,10c-dimethylpyren-2-yl)benzenecarbonitrile Openeye Name: 4-(10b,10c-dimethylpyren-2-yl)benzonitrile CAS Name: 4-(10b,10c-dimethyl-2-pyrenyl)benzonitrile IUPAC Name: 4-(10b,10c-dimethylpyren-2-yl)benzonitrile Traditional Name: 4-(10b,10c-dimethylpyren-2-yl)benzonitrile Formula: C25H19N MolecularWeight: 333.42506

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Descriptors Computed from Structure

Canonical SMILES:

CC12C3=CC=C4C1(C(=CC(=C4)C5=CC=C(C=C5)C#N)C=CC2=CC=C3)C

Isomeric SMILES

CC12C3=CC=C4C1(C(=CC(=C4)C5=CC=C(C=C5)C#N)C=CC2=CC=C3)C

InChI

InChI=1S/C25H19N/c1-24-20-4-3-5-21(24)11-13-23-15-19(14-22(12-10-20)25(23,24)2)18-8-6-17(16-26)7-9-18/h3-15H,1-2H3