methyl (4S,5S)-3-(4-chlorophenyl)-5-phenyl-4,5-dihydro-1,2-oxazole-4-carboxylate

Systemtic Name: methyl (4S,5S)-3-(4-chlorophenyl)-5-phenyl-4,5-dihydro-1,2-oxazole-4-carboxylate Openeye Name: methyl (4S,5S)-3-(4-chlorophenyl)-5-phenyl-4,5-dihydroisoxazole-4-carboxylate CAS Name: (4S,5S)-3-(4-chlorophenyl)-5-phenyl-4,5-dihydroisoxazole-4-carboxylic acid methyl ester IUPAC Name: methyl (4S,5S)-3-(4-chlorophenyl)-5-phenyl-4,5-dihydro-1,2-oxazole-4-carboxylate Traditional Name: (4S,5S)-3-(4-chlorophenyl)-5-phenyl-2-isoxazoline-4-carboxylic acid methyl ester Formula: C17H14ClNO3 MolecularWeight: 315.75096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(ON=C1C2=CC=C(C=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

COC(=O)[C@@H]1[C@H](ON=C1C2=CC=C(C=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C17H14ClNO3/c1-21-17(20)14-15(11-7-9-13(18)10-8-11)19-22-16(14)12-5-3-2-4-6-12/h2-10,14,16H,1H3/t14-,16+/m0/s1