6-(1-tert-butylcyclohexyl)-3-[2-(2-hydroxyphenyl)ethylcarbamoyl]hexanoic acid

Systemtic Name: 6-(1-tert-butylcyclohexyl)-3-[2-(2-hydroxyphenyl)ethylcarbamoyl]hexanoic acid Openeye Name: 6-(1-tert-butylcyclohexyl)-3-[2-(2-hydroxyphenyl)ethylcarbamoyl]hexanoic acid CAS Name: 6-(1-tert-butylcyclohexyl)-3-[[2-(2-hydroxyphenyl)ethylamino]-oxomethyl]hexanoic acid IUPAC Name: 6-(1-tert-butylcyclohexyl)-3-[2-(2-hydroxyphenyl)ethylcarbamoyl]hexanoic acid Traditional Name: 6-(1-tert-butylcyclohexyl)-3-[2-(2-hydroxyphenyl)ethylcarbamoyl]hexanoic acid Formula: C25H39NO4 MolecularWeight: 417.58146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1(CCCCC1)CCCC(CC(=O)O)C(=O)NCCC2=CC=CC=C2O

Isomeric SMILES

CC(C)(C)C1(CCCCC1)CCCC(CC(=O)O)C(=O)NCCC2=CC=CC=C2O

InChI

InChI=1S/C25H39NO4/c1-24(2,3)25(14-7-4-8-15-25)16-9-11-20(18-22(28)29)23(30)26-17-13-19-10-5-6-12-21(19)27/h5-6,10,12,20,27H,4,7-9,11,13-18H2,1-3H3,(H,26,30)(H,28,29)