4-[2-(1,1,3,3-tetramethyl-2H-inden-5-yl)ethynyl]benzenecarbonitrile

Systemtic Name: 4-[2-(1,1,3,3-tetramethyl-2H-inden-5-yl)ethynyl]benzenecarbonitrile Openeye Name: 4-[2-(1,1,3,3-tetramethylindan-5-yl)ethynyl]benzonitrile CAS Name: 4-[2-(1,1,3,3-tetramethyl-2H-inden-5-yl)ethynyl]benzonitrile IUPAC Name: 4-[2-(1,1,3,3-tetramethyl-2H-inden-5-yl)ethynyl]benzonitrile Traditional Name: 4-[2-(1,1,3,3-tetramethylindan-5-yl)ethynyl]benzonitrile Formula: C22H21N MolecularWeight: 299.40884

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=C1C=CC(=C2)C#CC3=CC=C(C=C3)C#N)(C)C)C

Isomeric SMILES

CC1(CC(C2=C1C=CC(=C2)C#CC3=CC=C(C=C3)C#N)(C)C)C

InChI

InChI=1S/C22H21N/c1-21(2)15-22(3,4)20-13-17(11-12-19(20)21)8-5-16-6-9-18(14-23)10-7-16/h6-7,9-13H,15H2,1-4H3