4-[2-(3,8,8-trimethyl-6,7-dihydro-5H-naphthalen-2-yl)ethynyl]benzenecarbonitrile

Systemtic Name: 4-[2-(3,8,8-trimethyl-6,7-dihydro-5H-naphthalen-2-yl)ethynyl]benzenecarbonitrile Openeye Name: 4-[2-(4,4,7-trimethyltetralin-6-yl)ethynyl]benzonitrile CAS Name: 4-[2-(3,8,8-trimethyl-6,7-dihydro-5H-naphthalen-2-yl)ethynyl]benzonitrile IUPAC Name: 4-[2-(3,8,8-trimethyl-6,7-dihydro-5H-naphthalen-2-yl)ethynyl]benzonitrile Traditional Name: 4-[2-(4,4,7-trimethyltetralin-6-yl)ethynyl]benzonitrile Formula: C22H21N MolecularWeight: 299.40884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C#CC3=CC=C(C=C3)C#N)C(CCC2)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1C#CC3=CC=C(C=C3)C#N)C(CCC2)(C)C

InChI

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