tert-butyl 6-cyclohexyl-3-[[2-oxidanylidene-4-(phenylmethyl)-1,3-oxazolidin-3-yl]carbonyl]hexanoate

Systemtic Name: tert-butyl 6-cyclohexyl-3-[[2-oxidanylidene-4-(phenylmethyl)-1,3-oxazolidin-3-yl]carbonyl]hexanoate Openeye Name: tert-butyl 3-(4-benzyl-2-oxo-oxazolidine-3-carbonyl)-6-cyclohexyl-hexanoate CAS Name: 6-cyclohexyl-3-[oxo-[2-oxo-4-(phenylmethyl)-3-oxazolidinyl]methyl]hexanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-(4-benzyl-2-oxo-1,3-oxazolidine-3-carbonyl)-6-cyclohexylhexanoate Traditional Name: 3-(4-benzyl-2-keto-oxazolidine-3-carbonyl)-6-cyclohexyl-hexanoic acid tert-butyl ester Formula: C27H39NO5 MolecularWeight: 457.60226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(CCCC1CCCCC1)C(=O)N2C(COC2=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)CC(CCCC1CCCCC1)C(=O)N2C(COC2=O)CC3=CC=CC=C3

InChI

InChI=1S/C27H39NO5/c1-27(2,3)33-24(29)18-22(16-10-15-20-11-6-4-7-12-20)25(30)28-23(19-32-26(28)31)17-21-13-8-5-9-14-21/h5,8-9,13-14,20,22-23H,4,6-7,10-12,15-19H2,1-3H3