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

Systemtic Name: 4-[3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)heptanoyloxy]benzoic acid Openeye Name: 4-[3-(1,1,4,4-tetramethyltetralin-6-yl)heptanoyloxy]benzoic acid CAS Name: 4-[1-oxo-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)heptoxy]benzoic acid IUPAC Name: 4-[3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)heptanoyloxy]benzoic acid Traditional Name: 4-[3-(1,1,4,4-tetramethyltetralin-6-yl)heptanoyloxy]benzoic acid Formula: C28H36O4 MolecularWeight: 436.58304

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(=O)OC1=CC=C(C=C1)C(=O)O)C2=CC3=C(C=C2)C(CCC3(C)C)(C)C

Isomeric SMILES

CCCCC(CC(=O)OC1=CC=C(C=C1)C(=O)O)C2=CC3=C(C=C2)C(CCC3(C)C)(C)C

InChI

InChI=1S/C28H36O4/c1-6-7-8-20(18-25(29)32-22-12-9-19(10-13-22)26(30)31)21-11-14-23-24(17-21)28(4,5)16-15-27(23,2)3/h9-14,17,20H,6-8,15-16,18H2,1-5H3,(H,30,31)