3-[2-(5,5-dimethyl-8-phenyl-7,8-dihydro-6H-naphthalen-2-yl)ethynyl]benzoic acid

Systemtic Name: 3-[2-(5,5-dimethyl-8-phenyl-7,8-dihydro-6H-naphthalen-2-yl)ethynyl]benzoic acid Openeye Name: 3-[2-(1,1-dimethyl-4-phenyl-tetralin-6-yl)ethynyl]benzoic acid CAS Name: 3-[2-(5,5-dimethyl-8-phenyl-7,8-dihydro-6H-naphthalen-2-yl)ethynyl]benzoic acid IUPAC Name: 3-[2-(5,5-dimethyl-8-phenyl-7,8-dihydro-6H-naphthalen-2-yl)ethynyl]benzoic acid Traditional Name: 3-[2-(1,1-dimethyl-4-phenyl-tetralin-6-yl)ethynyl]benzoic acid Formula: C27H24O2 MolecularWeight: 380.47826

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=C1C=CC(=C2)C#CC3=CC(=CC=C3)C(=O)O)C4=CC=CC=C4)C

Isomeric SMILES

CC1(CCC(C2=C1C=CC(=C2)C#CC3=CC(=CC=C3)C(=O)O)C4=CC=CC=C4)C

InChI

InChI=1S/C27H24O2/c1-27(2)16-15-23(21-8-4-3-5-9-21)24-18-20(13-14-25(24)27)12-11-19-7-6-10-22(17-19)26(28)29/h3-10,13-14,17-18,23H,15-16H2,1-2H3,(H,28,29)