4-[2-(5,5,8,8-tetramethyl-7-oxidanylidene-6H-naphthalen-2-yl)ethynyl]benzoic acid

Systemtic Name: 4-[2-(5,5,8,8-tetramethyl-7-oxidanylidene-6H-naphthalen-2-yl)ethynyl]benzoic acid Openeye Name: 4-[2-(1,1,4,4-tetramethyl-3-oxo-tetralin-6-yl)ethynyl]benzoic acid CAS Name: 4-[2-(5,5,8,8-tetramethyl-7-oxo-6H-naphthalen-2-yl)ethynyl]benzoic acid IUPAC Name: 4-[2-(5,5,8,8-tetramethyl-7-oxo-6H-naphthalen-2-yl)ethynyl]benzoic acid Traditional Name: 4-[2-(3-keto-1,1,4,4-tetramethyl-tetralin-6-yl)ethynyl]benzoic acid Formula: C23H22O3 MolecularWeight: 346.41898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22O3/c1-22(2)14-20(24)23(3,4)19-13-16(9-12-18(19)22)6-5-15-7-10-17(11-8-15)21(25)26/h7-13H,14H2,1-4H3,(H,25,26)