methyl 5-[acetyloxy-(5-phenyl-1,2-oxazol-3-yl)methyl]-3-(2-nitrophenyl)-4H-1,2-oxazole-5-carboxylate

Systemtic Name: methyl 5-[acetyloxy-(5-phenyl-1,2-oxazol-3-yl)methyl]-3-(2-nitrophenyl)-4H-1,2-oxazole-5-carboxylate Openeye Name: methyl 5-[acetoxy-(5-phenylisoxazol-3-yl)methyl]-3-(2-nitrophenyl)-4H-isoxazole-5-carboxylate CAS Name: 5-[acetyloxy-(5-phenyl-3-isoxazolyl)methyl]-3-(2-nitrophenyl)-4H-isoxazole-5-carboxylic acid methyl ester IUPAC Name: methyl 5-[acetyloxy-(5-phenyl-1,2-oxazol-3-yl)methyl]-3-(2-nitrophenyl)-4H-1,2-oxazole-5-carboxylate Traditional Name: 5-[acetoxy-(5-phenylisoxazol-3-yl)methyl]-3-(2-nitrophenyl)-2-isoxazoline-5-carboxylic acid methyl ester Formula: C23H19N3O8 MolecularWeight: 465.41226

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1=NOC(=C1)C2=CC=CC=C2)C3(CC(=NO3)C4=CC=CC=C4[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC(=O)OC(C1=NOC(=C1)C2=CC=CC=C2)C3(CC(=NO3)C4=CC=CC=C4[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C23H19N3O8/c1-14(27)32-21(17-12-20(33-24-17)15-8-4-3-5-9-15)23(22(28)31-2)13-18(25-34-23)16-10-6-7-11-19(16)26(29)30/h3-12,21H,13H2,1-2H3