ethyl 5-[(E)-C-methyl-N-[(4-nitrophenyl)amino]carbonimidoyl]-1,2-oxazole-3-carboxylate

Systemtic Name: ethyl 5-[(E)-C-methyl-N-[(4-nitrophenyl)amino]carbonimidoyl]-1,2-oxazole-3-carboxylate Openeye Name: ethyl 5-[(E)-C-methyl-N-(4-nitroanilino)carbonimidoyl]isoxazole-3-carboxylate CAS Name: 5-[(1E)-1-[(4-nitrophenyl)hydrazinylidene]ethyl]-3-isoxazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(E)-C-methyl-N-(4-nitroanilino)carbonimidoyl]-1,2-oxazole-3-carboxylate Traditional Name: 5-[(E)-C-methyl-N-(4-nitroanilino)carbonimidoyl]isoxazole-3-carboxylic acid ethyl ester Formula: C14H14N4O5 MolecularWeight: 318.28476

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NOC(=C1)C(=NNC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=NOC(=C1)/C(=N/NC2=CC=C(C=C2)[N+](=O)[O-])/C

InChI

InChI=1S/C14H14N4O5/c1-3-22-14(19)12-8-13(23-17-12)9(2)15-16-10-4-6-11(7-5-10)18(20)21/h4-8,16H,3H2,1-2H3/b15-9+