ethyl 5-[(4-ethoxy-2-nitro-phenyl)carbamoyl]-2-methyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-[(4-ethoxy-2-nitro-phenyl)carbamoyl]-2-methyl-pyrazole-3-carboxylate Openeye Name: ethyl 5-[(4-ethoxy-2-nitro-phenyl)carbamoyl]-2-methyl-pyrazole-3-carboxylate CAS Name: 5-[(4-ethoxy-2-nitroanilino)-oxomethyl]-2-methyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-ethoxy-2-nitrophenyl)carbamoyl]-2-methylpyrazole-3-carboxylate Traditional Name: 5-[(4-ethoxy-2-nitro-phenyl)carbamoyl]-2-methyl-pyrazole-3-carboxylic acid ethyl ester Formula: C16H18N4O6 MolecularWeight: 362.33732

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=O)C2=NN(C(=C2)C(=O)OCC)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=O)C2=NN(C(=C2)C(=O)OCC)C)[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O6/c1-4-25-10-6-7-11(13(8-10)20(23)24)17-15(21)12-9-14(19(3)18-12)16(22)26-5-2/h6-9H,4-5H2,1-3H3,(H,17,21)