ethyl 2-methyl-1-(4-nitrophenyl)-5-oxidanylidene-pyrazole-3-carboxylate

Systemtic Name: ethyl 2-methyl-1-(4-nitrophenyl)-5-oxidanylidene-pyrazole-3-carboxylate Openeye Name: ethyl 2-methyl-1-(4-nitrophenyl)-5-oxo-pyrazole-3-carboxylate CAS Name: 2-methyl-1-(4-nitrophenyl)-5-oxo-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-1-(4-nitrophenyl)-5-oxopyrazole-3-carboxylate Traditional Name: 5-keto-2-methyl-1-(4-nitrophenyl)-3-pyrazoline-3-carboxylic acid ethyl ester Formula: C13H13N3O5 MolecularWeight: 291.25942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=O)N(N1C)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=O)N(N1C)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O5/c1-3-21-13(18)11-8-12(17)15(14(11)2)9-4-6-10(7-5-9)16(19)20/h4-8H,3H2,1-2H3