ditert-butyl 3-(2,4,6-trimethylphenyl)-1,2-oxazole-4,5-dicarboxylate

Systemtic Name: ditert-butyl 3-(2,4,6-trimethylphenyl)-1,2-oxazole-4,5-dicarboxylate Openeye Name: ditert-butyl 3-(2,4,6-trimethylphenyl)isoxazole-4,5-dicarboxylate CAS Name: 3-(2,4,6-trimethylphenyl)isoxazole-4,5-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 3-(2,4,6-trimethylphenyl)-1,2-oxazole-4,5-dicarboxylate Traditional Name: 3-mesitylisoxazole-4,5-dicarboxylic acid ditert-butyl ester Formula: C22H29NO5 MolecularWeight: 387.46936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C2=NOC(=C2C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C2=NOC(=C2C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C22H29NO5/c1-12-10-13(2)15(14(3)11-12)17-16(19(24)26-21(4,5)6)18(28-23-17)20(25)27-22(7,8)9/h10-11H,1-9H3