ethyl 4-(4-nitrophenyl)carbonyl-1,2-oxazole-3-carboxylate

Systemtic Name: ethyl 4-(4-nitrophenyl)carbonyl-1,2-oxazole-3-carboxylate Openeye Name: ethyl 4-(4-nitrobenzoyl)isoxazole-3-carboxylate CAS Name: 4-[(4-nitrophenyl)-oxomethyl]-3-isoxazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-nitrobenzoyl)-1,2-oxazole-3-carboxylate Traditional Name: 4-(4-nitrobenzoyl)isoxazole-3-carboxylic acid ethyl ester Formula: C13H10N2O6 MolecularWeight: 290.2283

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NOC=C1C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=NOC=C1C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H10N2O6/c1-2-20-13(17)11-10(7-21-14-11)12(16)8-3-5-9(6-4-8)15(18)19/h3-7H,2H2,1H3