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

Systemtic Name: methyl 4-[(3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)carbonylamino]benzoate Openeye Name: methyl 4-[(3-phenyl-4,5-dihydroisoxazole-5-carbonyl)amino]benzoate CAS Name: 4-[[oxo-(3-phenyl-4,5-dihydroisoxazol-5-yl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(3-phenyl-4,5-dihydro-1,2-oxazole-5-carbonyl)amino]benzoate Traditional Name: 4-[(3-phenyl-2-isoxazoline-5-carbonyl)amino]benzoic acid methyl ester Formula: C18H16N2O4 MolecularWeight: 324.33064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C2CC(=NO2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C2CC(=NO2)C3=CC=CC=C3

InChI

InChI=1S/C18H16N2O4/c1-23-18(22)13-7-9-14(10-8-13)19-17(21)16-11-15(20-24-16)12-5-3-2-4-6-12/h2-10,16H,11H2,1H3,(H,19,21)