[1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(3,5-dimethyl-1,2-oxazol-4-yl)ethanoate

Systemtic Name: [1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(3,5-dimethyl-1,2-oxazol-4-yl)ethanoate Openeye Name: [1-methyl-2-(2-nitroanilino)-2-oxo-ethyl] 2-(3,5-dimethylisoxazol-4-yl)acetate CAS Name: 2-(3,5-dimethyl-4-isoxazolyl)acetic acid [1-(2-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-nitroanilino)-1-oxopropan-2-yl] 2-(3,5-dimethyl-1,2-oxazol-4-yl)acetate Traditional Name: 2-(3,5-dimethylisoxazol-4-yl)acetic acid [2-keto-1-methyl-2-(2-nitroanilino)ethyl] ester Formula: C16H17N3O6 MolecularWeight: 347.32268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CC(=O)OC(C)C(=O)NC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NO1)C)CC(=O)OC(C)C(=O)NC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O6/c1-9-12(10(2)25-18-9)8-15(20)24-11(3)16(21)17-13-6-4-5-7-14(13)19(22)23/h4-7,11H,8H2,1-3H3,(H,17,21)