6-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)ethynyl]pyridine-3-carboxylic acid

Systemtic Name: 6-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)ethynyl]pyridine-3-carboxylic acid Openeye Name: 6-[2-(1,1,4,4-tetramethyltetralin-6-yl)ethynyl]pyridine-3-carboxylic acid CAS Name: 6-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)ethynyl]-3-pyridinecarboxylic acid IUPAC Name: 6-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)ethynyl]pyridine-3-carboxylic acid Traditional Name: 6-[2-(1,1,4,4-tetramethyltetralin-6-yl)ethynyl]nicotinic acid Formula: C22H23NO2 MolecularWeight: 333.42352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23NO2/c1-21(2)11-12-22(3,4)19-13-15(6-10-18(19)21)5-8-17-9-7-16(14-23-17)20(24)25/h6-7,9-10,13-14H,11-12H2,1-4H3,(H,24,25)