methyl 2-[[3-(3-bromophenyl)-4,5-dihydro-1,2-oxazol-5-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[3-(3-bromophenyl)-4,5-dihydro-1,2-oxazol-5-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[3-(3-bromophenyl)-4,5-dihydroisoxazole-5-carbonyl]amino]benzoate CAS Name: 2-[[[3-(3-bromophenyl)-4,5-dihydroisoxazol-5-yl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carbonyl]amino]benzoate Traditional Name: 2-[[3-(3-bromophenyl)-2-isoxazoline-5-carbonyl]amino]benzoic acid methyl ester Formula: C18H15BrN2O4 MolecularWeight: 403.2267

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C2CC(=NO2)C3=CC(=CC=C3)Br

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)C2CC(=NO2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C18H15BrN2O4/c1-24-18(23)13-7-2-3-8-14(13)20-17(22)16-10-15(21-25-16)11-5-4-6-12(19)9-11/h2-9,16H,10H2,1H3,(H,20,22)