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

Systemtic Name: methyl (4S,5S)-3-(3-nitrophenyl)-4-phenyl-4,5-dihydro-1,2-oxazole-5-carboxylate Openeye Name: methyl (4S,5S)-3-(3-nitrophenyl)-4-phenyl-4,5-dihydroisoxazole-5-carboxylate CAS Name: (4S,5S)-3-(3-nitrophenyl)-4-phenyl-4,5-dihydroisoxazole-5-carboxylic acid methyl ester IUPAC Name: methyl (4S,5S)-3-(3-nitrophenyl)-4-phenyl-4,5-dihydro-1,2-oxazole-5-carboxylate Traditional Name: (4S,5S)-3-(3-nitrophenyl)-4-phenyl-2-isoxazoline-5-carboxylic acid methyl ester Formula: C17H14N2O5 MolecularWeight: 326.30346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(C(=NO1)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

COC(=O)[C@@H]1[C@H](C(=NO1)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C17H14N2O5/c1-23-17(20)16-14(11-6-3-2-4-7-11)15(18-24-16)12-8-5-9-13(10-12)19(21)22/h2-10,14,16H,1H3/t14-,16-/m0/s1