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

Systemtic Name: 6-(1-tert-butylcyclohexyl)-3-[(1-methoxy-3-oxidanyl-1-oxidanylidene-butan-2-yl)carbamoyl]hexanoic acid Openeye Name: 6-(1-tert-butylcyclohexyl)-3-[(2-hydroxy-1-methoxycarbonyl-propyl)carbamoyl]hexanoic acid CAS Name: 6-(1-tert-butylcyclohexyl)-3-[[(3-hydroxy-1-methoxy-1-oxobutan-2-yl)amino]-oxomethyl]hexanoic acid IUPAC Name: 6-(1-tert-butylcyclohexyl)-3-[(3-hydroxy-1-methoxy-1-oxobutan-2-yl)carbamoyl]hexanoic acid Traditional Name: 6-(1-tert-butylcyclohexyl)-3-[(1-carbomethoxy-2-hydroxy-propyl)carbamoyl]hexanoic acid Formula: C22H39NO6 MolecularWeight: 413.54816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)OC)NC(=O)C(CCCC1(CCCCC1)C(C)(C)C)CC(=O)O)O

Isomeric SMILES

CC(C(C(=O)OC)NC(=O)C(CCCC1(CCCCC1)C(C)(C)C)CC(=O)O)O

InChI

InChI=1S/C22H39NO6/c1-15(24)18(20(28)29-5)23-19(27)16(14-17(25)26)10-9-13-22(21(2,3)4)11-7-6-8-12-22/h15-16,18,24H,6-14H2,1-5H3,(H,23,27)(H,25,26)