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

Systemtic Name: 4-[3-(5,5-dimethyl-7,8-dihydro-6H-naphthalen-2-yl)-3-oxidanyl-prop-1-ynyl]-2-oxidanyl-benzoic acid Openeye Name: 4-[3-(1,1-dimethyltetralin-6-yl)-3-hydroxy-prop-1-ynyl]-2-hydroxy-benzoic acid CAS Name: 4-[3-(5,5-dimethyl-7,8-dihydro-6H-naphthalen-2-yl)-3-hydroxyprop-1-ynyl]-2-hydroxybenzoic acid IUPAC Name: 4-[3-(5,5-dimethyl-7,8-dihydro-6H-naphthalen-2-yl)-3-hydroxyprop-1-ynyl]-2-hydroxybenzoic acid Traditional Name: 4-[3-(1,1-dimethyltetralin-6-yl)-3-hydroxy-prop-1-ynyl]-2-hydroxy-benzoic acid Formula: C22H22O4 MolecularWeight: 350.40768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22O4/c1-22(2)11-3-4-15-13-16(7-9-18(15)22)19(23)10-6-14-5-8-17(21(25)26)20(24)12-14/h5,7-9,12-13,19,23-24H,3-4,11H2,1-2H3,(H,25,26)