4-[3-(5,5-dimethyl-7,8-dihydro-6H-naphthalen-2-yl)prop-1-ynyl]-2-oxidanyl-benzoic acid

Systemtic Name: 4-[3-(5,5-dimethyl-7,8-dihydro-6H-naphthalen-2-yl)prop-1-ynyl]-2-oxidanyl-benzoic acid Openeye Name: 4-[3-(1,1-dimethyltetralin-6-yl)prop-1-ynyl]-2-hydroxy-benzoic acid CAS Name: 4-[3-(5,5-dimethyl-7,8-dihydro-6H-naphthalen-2-yl)prop-1-ynyl]-2-hydroxybenzoic acid IUPAC Name: 4-[3-(5,5-dimethyl-7,8-dihydro-6H-naphthalen-2-yl)prop-1-ynyl]-2-hydroxybenzoic acid Traditional Name: 4-[3-(1,1-dimethyltetralin-6-yl)prop-1-ynyl]-2-hydroxy-benzoic acid Formula: C22H22O3 MolecularWeight: 334.40828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22O3/c1-22(2)12-4-7-17-13-15(9-11-19(17)22)5-3-6-16-8-10-18(21(24)25)20(23)14-16/h8-11,13-14,23H,4-5,7,12H2,1-2H3,(H,24,25)