methyl (4R,5R)-5-tert-butyl-3-nonyl-4,5-dihydro-1,2-oxazole-4-carboxylate

Systemtic Name: methyl (4R,5R)-5-tert-butyl-3-nonyl-4,5-dihydro-1,2-oxazole-4-carboxylate Openeye Name: methyl (4R,5R)-5-tert-butyl-3-nonyl-4,5-dihydroisoxazole-4-carboxylate CAS Name: (4R,5R)-5-tert-butyl-3-nonyl-4,5-dihydroisoxazole-4-carboxylic acid methyl ester IUPAC Name: methyl (4R,5R)-5-tert-butyl-3-nonyl-4,5-dihydro-1,2-oxazole-4-carboxylate Traditional Name: (4R,5R)-5-tert-butyl-3-nonyl-2-isoxazoline-4-carboxylic acid methyl ester Formula: C18H33NO3 MolecularWeight: 311.45952

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=NOC(C1C(=O)OC)C(C)(C)C

Isomeric SMILES

CCCCCCCCCC1=NO[C@H]([C@@H]1C(=O)OC)C(C)(C)C

InChI

InChI=1S/C18H33NO3/c1-6-7-8-9-10-11-12-13-14-15(17(20)21-5)16(22-19-14)18(2,3)4/h15-16H,6-13H2,1-5H3/t15-,16-/m1/s1