6-(1-tert-butylcyclohexyl)-3-[(1-ethoxy-3-oxidanyl-1-oxidanylidene-propan-2-yl)carbamoyl]hexanoic acid

Systemtic Name: 6-(1-tert-butylcyclohexyl)-3-[(1-ethoxy-3-oxidanyl-1-oxidanylidene-propan-2-yl)carbamoyl]hexanoic acid Openeye Name: 6-(1-tert-butylcyclohexyl)-3-[[2-ethoxy-1-(hydroxymethyl)-2-oxo-ethyl]carbamoyl]hexanoic acid CAS Name: 6-(1-tert-butylcyclohexyl)-3-[[(1-ethoxy-3-hydroxy-1-oxopropan-2-yl)amino]-oxomethyl]hexanoic acid IUPAC Name: 6-(1-tert-butylcyclohexyl)-3-[(1-ethoxy-3-hydroxy-1-oxopropan-2-yl)carbamoyl]hexanoic acid Traditional Name: 6-(1-tert-butylcyclohexyl)-3-[(2-ethoxy-2-keto-1-methylol-ethyl)carbamoyl]hexanoic acid Formula: C22H39NO6 MolecularWeight: 413.54816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CO)NC(=O)C(CCCC1(CCCCC1)C(C)(C)C)CC(=O)O

Isomeric SMILES

CCOC(=O)C(CO)NC(=O)C(CCCC1(CCCCC1)C(C)(C)C)CC(=O)O

InChI

InChI=1S/C22H39NO6/c1-5-29-20(28)17(15-24)23-19(27)16(14-18(25)26)10-9-13-22(21(2,3)4)11-7-6-8-12-22/h16-17,24H,5-15H2,1-4H3,(H,23,27)(H,25,26)