tert-butyl 6-cyclohexyl-3-[(1-methoxy-3-oxidanyl-1-oxidanylidene-butan-2-yl)carbamoyl]hexanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)OC)NC(=O)C(CCCC1CCCCC1)CC(=O)OC(C)(C)C)O

Isomeric SMILES

CC(C(C(=O)OC)NC(=O)C(CCCC1CCCCC1)CC(=O)OC(C)(C)C)O

InChI

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