3-(3-bromophenyl)-N-(2-methoxy-4-nitro-phenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide

Systemtic Name: 3-(3-bromophenyl)-N-(2-methoxy-4-nitro-phenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide Openeye Name: 3-(3-bromophenyl)-N-(2-methoxy-4-nitro-phenyl)-4,5-dihydroisoxazole-5-carboxamide CAS Name: 3-(3-bromophenyl)-N-(2-methoxy-4-nitrophenyl)-4,5-dihydroisoxazole-5-carboxamide IUPAC Name: 3-(3-bromophenyl)-N-(2-methoxy-4-nitrophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide Traditional Name: 3-(3-bromophenyl)-N-(2-methoxy-4-nitro-phenyl)-2-isoxazoline-5-carboxamide Formula: C17H14BrN3O5 MolecularWeight: 420.21416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2CC(=NO2)C3=CC(=CC=C3)Br

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2CC(=NO2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H14BrN3O5/c1-25-15-8-12(21(23)24)5-6-13(15)19-17(22)16-9-14(20-26-16)10-3-2-4-11(18)7-10/h2-8,16H,9H2,1H3,(H,19,22)