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

Systemtic Name: 6-[2-(8,8-dimethyl-6,7-dihydro-5H-naphthalen-2-yl)ethynyl]pyridine-3-carboxylic acid Openeye Name: 6-[2-(4,4-dimethyltetralin-6-yl)ethynyl]pyridine-3-carboxylic acid CAS Name: 6-[2-(8,8-dimethyl-6,7-dihydro-5H-naphthalen-2-yl)ethynyl]-3-pyridinecarboxylic acid IUPAC Name: 6-[2-(8,8-dimethyl-6,7-dihydro-5H-naphthalen-2-yl)ethynyl]pyridine-3-carboxylic acid Traditional Name: 6-[2-(4,4-dimethyltetralin-6-yl)ethynyl]nicotinic acid Formula: C20H19NO2 MolecularWeight: 305.37036

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC2=C1C=C(C=C2)C#CC3=NC=C(C=C3)C(=O)O)C

Isomeric SMILES

CC1(CCCC2=C1C=C(C=C2)C#CC3=NC=C(C=C3)C(=O)O)C

InChI

InChI=1S/C20H19NO2/c1-20(2)11-3-4-15-7-5-14(12-18(15)20)6-9-17-10-8-16(13-21-17)19(22)23/h5,7-8,10,12-13H,3-4,11H2,1-2H3,(H,22,23)