methyl (4R,5S)-5-ethyl-3-(2,4,6-trimethylphenyl)-4,5-dihydro-1,2-oxazole-4-carboxylate

Systemtic Name: methyl (4R,5S)-5-ethyl-3-(2,4,6-trimethylphenyl)-4,5-dihydro-1,2-oxazole-4-carboxylate Openeye Name: methyl (4R,5S)-5-ethyl-3-(2,4,6-trimethylphenyl)-4,5-dihydroisoxazole-4-carboxylate CAS Name: (4R,5S)-5-ethyl-3-(2,4,6-trimethylphenyl)-4,5-dihydroisoxazole-4-carboxylic acid methyl ester IUPAC Name: methyl (4R,5S)-5-ethyl-3-(2,4,6-trimethylphenyl)-4,5-dihydro-1,2-oxazole-4-carboxylate Traditional Name: (4R,5S)-5-ethyl-3-mesityl-2-isoxazoline-4-carboxylic acid methyl ester Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C(=NO1)C2=C(C=C(C=C2C)C)C)C(=O)OC

Isomeric SMILES

CC[C@H]1[C@@H](C(=NO1)C2=C(C=C(C=C2C)C)C)C(=O)OC

InChI

InChI=1S/C16H21NO3/c1-6-12-14(16(18)19-5)15(17-20-12)13-10(3)7-9(2)8-11(13)4/h7-8,12,14H,6H2,1-5H3/t12-,14-/m0/s1