tert-butyl 4-cyano-2,5-diphenyl-2H-1,3-oxazole-3-carboxylate

Systemtic Name: tert-butyl 4-cyano-2,5-diphenyl-2H-1,3-oxazole-3-carboxylate Openeye Name: tert-butyl 4-cyano-2,5-diphenyl-2H-oxazole-3-carboxylate CAS Name: 4-cyano-2,5-diphenyl-2H-oxazole-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-cyano-2,5-diphenyl-2H-1,3-oxazole-3-carboxylate Traditional Name: 4-cyano-2,5-diphenyl-4-oxazoline-3-carboxylic acid tert-butyl ester Formula: C21H20N2O3 MolecularWeight: 348.3951

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(OC(=C1C#N)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1C(OC(=C1C#N)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H20N2O3/c1-21(2,3)26-20(24)23-17(14-22)18(15-10-6-4-7-11-15)25-19(23)16-12-8-5-9-13-16/h4-13,19H,1-3H3