4-[2-(5,5,8-trimethyl-6H-naphthalen-2-yl)ethynyl]benzoic acid

Systemtic Name: 4-[2-(5,5,8-trimethyl-6H-naphthalen-2-yl)ethynyl]benzoic acid Openeye Name: 4-[2-(5,5,8-trimethyl-6H-naphthalen-2-yl)ethynyl]benzoic acid CAS Name: 4-[2-(5,5,8-trimethyl-6H-naphthalen-2-yl)ethynyl]benzoic acid IUPAC Name: 4-[2-(5,5,8-trimethyl-6H-naphthalen-2-yl)ethynyl]benzoic acid Traditional Name: 4-[2-(5,5,8-trimethyl-6H-naphthalen-2-yl)ethynyl]benzoic acid Formula: C22H20O2 MolecularWeight: 316.393

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(C2=C1C=C(C=C2)C#CC3=CC=C(C=C3)C(=O)O)(C)C

Isomeric SMILES

CC1=CCC(C2=C1C=C(C=C2)C#CC3=CC=C(C=C3)C(=O)O)(C)C

InChI

InChI=1S/C22H20O2/c1-15-12-13-22(2,3)20-11-8-17(14-19(15)20)5-4-16-6-9-18(10-7-16)21(23)24/h6-12,14H,13H2,1-3H3,(H,23,24)