2-[2-(2-cyclohexylethyl)-1-[(2-methylpropan-2-yl)oxy]-4-oxidanylidene-butyl]-5-methyl-1,3-oxazole-4-carboxylic acid

Systemtic Name: 2-[2-(2-cyclohexylethyl)-1-[(2-methylpropan-2-yl)oxy]-4-oxidanylidene-butyl]-5-methyl-1,3-oxazole-4-carboxylic acid Openeye Name: 2-[1-tert-butoxy-2-(2-cyclohexylethyl)-4-oxo-butyl]-5-methyl-oxazole-4-carboxylic acid CAS Name: 2-[2-(2-cyclohexylethyl)-1-[(2-methylpropan-2-yl)oxy]-4-oxobutyl]-5-methyl-4-oxazolecarboxylic acid IUPAC Name: 2-[2-(2-cyclohexylethyl)-1-[(2-methylpropan-2-yl)oxy]-4-oxobutyl]-5-methyl-1,3-oxazole-4-carboxylic acid Traditional Name: 2-[1-tert-butoxy-2-(2-cyclohexylethyl)-4-keto-butyl]-5-methyl-oxazole-4-carboxylic acid Formula: C21H33NO5 MolecularWeight: 379.49042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C(C(CCC2CCCCC2)CC=O)OC(C)(C)C)C(=O)O

Isomeric SMILES

CC1=C(N=C(O1)C(C(CCC2CCCCC2)CC=O)OC(C)(C)C)C(=O)O

InChI

InChI=1S/C21H33NO5/c1-14-17(20(24)25)22-19(26-14)18(27-21(2,3)4)16(12-13-23)11-10-15-8-6-5-7-9-15/h13,15-16,18H,5-12H2,1-4H3,(H,24,25)