methyl (4S,5S)-5-(4-cyanophenyl)-2-(2-methoxyphenyl)-4,5-dihydro-1,3-oxazole-4-carboxylate

Systemtic Name: methyl (4S,5S)-5-(4-cyanophenyl)-2-(2-methoxyphenyl)-4,5-dihydro-1,3-oxazole-4-carboxylate Openeye Name: methyl (4S,5S)-5-(4-cyanophenyl)-2-(2-methoxyphenyl)-4,5-dihydrooxazole-4-carboxylate CAS Name: (4S,5S)-5-(4-cyanophenyl)-2-(2-methoxyphenyl)-4,5-dihydrooxazole-4-carboxylic acid methyl ester IUPAC Name: methyl (4S,5S)-5-(4-cyanophenyl)-2-(2-methoxyphenyl)-4,5-dihydro-1,3-oxazole-4-carboxylate Traditional Name: (4S,5S)-5-(4-cyanophenyl)-2-(2-methoxyphenyl)-2-oxazoline-4-carboxylic acid methyl ester Formula: C19H16N2O4 MolecularWeight: 336.34134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NC(C(O2)C3=CC=C(C=C3)C#N)C(=O)OC

Isomeric SMILES

COC1=CC=CC=C1C2=N[C@@H]([C@@H](O2)C3=CC=C(C=C3)C#N)C(=O)OC

InChI

InChI=1S/C19H16N2O4/c1-23-15-6-4-3-5-14(15)18-21-16(19(22)24-2)17(25-18)13-9-7-12(11-20)8-10-13/h3-10,16-17H,1-2H3/t16-,17-/m0/s1