4-[3-oxidanylidene-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-ynyl]benzoic acid

Systemtic Name: 4-[3-oxidanylidene-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-ynyl]benzoic acid Openeye Name: 4-[3-oxo-3-(1,1,4,4-tetramethyltetralin-6-yl)prop-1-ynyl]benzoic acid CAS Name: 4-[3-oxo-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-ynyl]benzoic acid IUPAC Name: 4-[3-oxo-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-ynyl]benzoic acid Traditional Name: 4-[3-keto-3-(1,1,4,4-tetramethyltetralin-6-yl)prop-1-ynyl]benzoic acid Formula: C24H24O3 MolecularWeight: 360.44556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H24O3/c1-23(2)13-14-24(3,4)20-15-18(10-11-19(20)23)21(25)12-7-16-5-8-17(9-6-16)22(26)27/h5-6,8-11,15H,13-14H2,1-4H3,(H,26,27)