5-[3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-ynyl]thiophene-3-carboxylic acid

Systemtic Name: 5-[3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-ynyl]thiophene-3-carboxylic acid Openeye Name: 5-[3-(1,1,4,4-tetramethyltetralin-6-yl)prop-1-ynyl]thiophene-3-carboxylic acid CAS Name: 5-[3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-ynyl]-3-thiophenecarboxylic acid IUPAC Name: 5-[3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-ynyl]thiophene-3-carboxylic acid Traditional Name: 5-[3-(1,1,4,4-tetramethyltetralin-6-yl)prop-1-ynyl]-3-thenoic acid Formula: C22H24O2S MolecularWeight: 352.48976

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=C1C=CC(=C2)CC#CC3=CC(=CS3)C(=O)O)(C)C)C

Isomeric SMILES

CC1(CCC(C2=C1C=CC(=C2)CC#CC3=CC(=CS3)C(=O)O)(C)C)C

InChI

InChI=1S/C22H24O2S/c1-21(2)10-11-22(3,4)19-12-15(8-9-18(19)21)6-5-7-17-13-16(14-25-17)20(23)24/h8-9,12-14H,6,10-11H2,1-4H3,(H,23,24)