ethyl (4R,5S)-5-(4-cyanophenyl)-4,5-dihydro-1,3-oxazole-4-carboxylate

Systemtic Name: ethyl (4R,5S)-5-(4-cyanophenyl)-4,5-dihydro-1,3-oxazole-4-carboxylate Openeye Name: ethyl (4R,5S)-5-(4-cyanophenyl)-4,5-dihydrooxazole-4-carboxylate CAS Name: (4R,5S)-5-(4-cyanophenyl)-4,5-dihydrooxazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl (4R,5S)-5-(4-cyanophenyl)-4,5-dihydro-1,3-oxazole-4-carboxylate Traditional Name: (4R,5S)-5-(4-cyanophenyl)-2-oxazoline-4-carboxylic acid ethyl ester Formula: C13H12N2O3 MolecularWeight: 244.24598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(OC=N1)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCOC(=O)[C@H]1[C@@H](OC=N1)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C13H12N2O3/c1-2-17-13(16)11-12(18-8-15-11)10-5-3-9(7-14)4-6-10/h3-6,8,11-12H,2H2,1H3/t11-,12+/m1/s1