2-(8,8a-dihydronaphthalen-1-yl)-2-(2,2-diethylbutanoyloxy)heptanoic acid

Systemtic Name: 2-(8,8a-dihydronaphthalen-1-yl)-2-(2,2-diethylbutanoyloxy)heptanoic acid Openeye Name: 2-(8,8a-dihydronaphthalen-1-yl)-2-(2,2-diethylbutanoyloxy)heptanoic acid CAS Name: 2-(8,8a-dihydronaphthalen-1-yl)-2-(2,2-diethyl-1-oxobutoxy)heptanoic acid IUPAC Name: 2-(8,8a-dihydronaphthalen-1-yl)-2-(2,2-diethylbutanoyloxy)heptanoic acid Traditional Name: 2-(8,8a-dihydronaphthalen-1-yl)-2-(2,2-diethylbutanoyloxy)enanthic acid Formula: C25H36O4 MolecularWeight: 400.55094

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CC=CC2=CC=CCC21)(C(=O)O)OC(=O)C(CC)(CC)CC

Isomeric SMILES

CCCCCC(C1=CC=CC2=CC=CCC21)(C(=O)O)OC(=O)C(CC)(CC)CC

InChI

InChI=1S/C25H36O4/c1-5-9-12-18-25(22(26)27,29-23(28)24(6-2,7-3)8-4)21-17-13-15-19-14-10-11-16-20(19)21/h10-11,13-15,17,20H,5-9,12,16,18H2,1-4H3,(H,26,27)