4-[2-[(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)sulfanyl]ethynyl]benzoate

Systemtic Name: 4-[2-[(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)sulfanyl]ethynyl]benzoate Openeye Name: 4-[2-(1,1,4,4-tetramethyltetralin-6-yl)sulfanylethynyl]benzoate CAS Name: 4-[2-[(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)thio]ethynyl]benzoate IUPAC Name: 4-[2-[(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)sulfanyl]ethynyl]benzoate Traditional Name: 4-[2-[(1,1,4,4-tetramethyltetralin-6-yl)thio]ethynyl]benzoate Formula: C23H23O2S- MolecularWeight: 363.49252

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=C1C=CC(=C2)SC#CC3=CC=C(C=C3)C(=O)[O-])(C)C)C

Isomeric SMILES

CC1(CCC(C2=C1C=CC(=C2)SC#CC3=CC=C(C=C3)C(=O)[O-])(C)C)C

InChI

InChI=1S/C23H24O2S/c1-22(2)12-13-23(3,4)20-15-18(9-10-19(20)22)26-14-11-16-5-7-17(8-6-16)21(24)25/h5-10,15H,12-13H2,1-4H3,(H,24,25)/p-1