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

Systemtic Name: methyl 3-(4-nitrophenyl)-5-[oxidanyl-(3-phenyl-1,2-oxazol-5-yl)methyl]-4H-1,2-oxazole-5-carboxylate Openeye Name: methyl 5-[hydroxy-(3-phenylisoxazol-5-yl)methyl]-3-(4-nitrophenyl)-4H-isoxazole-5-carboxylate CAS Name: 5-[hydroxy-(3-phenyl-5-isoxazolyl)methyl]-3-(4-nitrophenyl)-4H-isoxazole-5-carboxylic acid methyl ester IUPAC Name: methyl 5-[hydroxy-(3-phenyl-1,2-oxazol-5-yl)methyl]-3-(4-nitrophenyl)-4H-1,2-oxazole-5-carboxylate Traditional Name: 5-[hydroxy-(3-phenylisoxazol-5-yl)methyl]-3-(4-nitrophenyl)-2-isoxazoline-5-carboxylic acid methyl ester Formula: C21H17N3O7 MolecularWeight: 423.37558

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CC(=NO1)C2=CC=C(C=C2)[N+](=O)[O-])C(C3=CC(=NO3)C4=CC=CC=C4)O

Isomeric SMILES

COC(=O)C1(CC(=NO1)C2=CC=C(C=C2)[N+](=O)[O-])C(C3=CC(=NO3)C4=CC=CC=C4)O

InChI

InChI=1S/C21H17N3O7/c1-29-20(26)21(12-17(23-31-21)14-7-9-15(10-8-14)24(27)28)19(25)18-11-16(22-30-18)13-5-3-2-4-6-13/h2-11,19,25H,12H2,1H3