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

Systemtic Name: 4-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-dithiolan-2-yl]benzoic acid Openeye Name: 4-[2-(1,1,4,4-tetramethyltetralin-6-yl)-1,3-dithiolan-2-yl]benzoic acid CAS Name: 4-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-dithiolan-2-yl]benzoic acid IUPAC Name: 4-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-dithiolan-2-yl]benzoic acid Traditional Name: 4-[2-(1,1,4,4-tetramethyltetralin-6-yl)-1,3-dithiolan-2-yl]benzoic acid Formula: C24H28O2S2 MolecularWeight: 412.60792

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=C1C=CC(=C2)C3(SCCS3)C4=CC=C(C=C4)C(=O)O)(C)C)C

Isomeric SMILES

CC1(CCC(C2=C1C=CC(=C2)C3(SCCS3)C4=CC=C(C=C4)C(=O)O)(C)C)C

InChI

InChI=1S/C24H28O2S2/c1-22(2)11-12-23(3,4)20-15-18(9-10-19(20)22)24(27-13-14-28-24)17-7-5-16(6-8-17)21(25)26/h5-10,15H,11-14H2,1-4H3,(H,25,26)