6-[2-(2,6,6-trimethylcyclohexen-1-yl)ethynyl]naphthalene-2-carboxylic acid

Systemtic Name: 6-[2-(2,6,6-trimethylcyclohexen-1-yl)ethynyl]naphthalene-2-carboxylic acid Openeye Name: 6-[2-(2,6,6-trimethylcyclohexen-1-yl)ethynyl]naphthalene-2-carboxylic acid CAS Name: 6-[2-(2,6,6-trimethyl-1-cyclohexenyl)ethynyl]-2-naphthalenecarboxylic acid IUPAC Name: 6-[2-(2,6,6-trimethylcyclohexen-1-yl)ethynyl]naphthalene-2-carboxylic acid Traditional Name: 6-[2-(2,6,6-trimethylcyclohexen-1-yl)ethynyl]-2-naphthoic acid Formula: C22H22O2 MolecularWeight: 318.40888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1)(C)C)C#CC2=CC3=C(C=C2)C=C(C=C3)C(=O)O

Isomeric SMILES

CC1=C(C(CCC1)(C)C)C#CC2=CC3=C(C=C2)C=C(C=C3)C(=O)O

InChI

InChI=1S/C22H22O2/c1-15-5-4-12-22(2,3)20(15)11-7-16-6-8-18-14-19(21(23)24)10-9-17(18)13-16/h6,8-10,13-14H,4-5,12H2,1-3H3,(H,23,24)