tert-butyl 6-cyclohexyl-3-[(2-oxidanyl-4-oxidanylidene-pentan-3-yl)carbamoyl]hexanoate

Systemtic Name: tert-butyl 6-cyclohexyl-3-[(2-oxidanyl-4-oxidanylidene-pentan-3-yl)carbamoyl]hexanoate Openeye Name: tert-butyl 3-[(1-acetyl-2-hydroxy-propyl)carbamoyl]-6-cyclohexyl-hexanoate CAS Name: 6-cyclohexyl-3-[[(2-hydroxy-4-oxopentan-3-yl)amino]-oxomethyl]hexanoic acid tert-butyl ester IUPAC Name: tert-butyl 6-cyclohexyl-3-[(2-hydroxy-4-oxopentan-3-yl)carbamoyl]hexanoate Traditional Name: 3-[(1-acetyl-2-hydroxy-propyl)carbamoyl]-6-cyclohexyl-hexanoic acid tert-butyl ester Formula: C22H39NO5 MolecularWeight: 397.54876

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H39NO5/c1-15(24)20(16(2)25)23-21(27)18(14-19(26)28-22(3,4)5)13-9-12-17-10-7-6-8-11-17/h15,17-18,20,24H,6-14H2,1-5H3,(H,23,27)