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

Systemtic Name: ethyl 5-[[3-(2-methoxyphenoxy)-5-nitro-phenyl]carbamoyl]-2-methyl-pyrazole-3-carboxylate Openeye Name: ethyl 5-[[3-(2-methoxyphenoxy)-5-nitro-phenyl]carbamoyl]-2-methyl-pyrazole-3-carboxylate CAS Name: 5-[[3-(2-methoxyphenoxy)-5-nitroanilino]-oxomethyl]-2-methyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[3-(2-methoxyphenoxy)-5-nitrophenyl]carbamoyl]-2-methylpyrazole-3-carboxylate Traditional Name: 5-[[3-(2-methoxyphenoxy)-5-nitro-phenyl]carbamoyl]-2-methyl-pyrazole-3-carboxylic acid ethyl ester Formula: C21H20N4O7 MolecularWeight: 440.4061

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NN1C)C(=O)NC2=CC(=CC(=C2)OC3=CC=CC=C3OC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=NN1C)C(=O)NC2=CC(=CC(=C2)OC3=CC=CC=C3OC)[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O7/c1-4-31-21(27)17-12-16(23-24(17)2)20(26)22-13-9-14(25(28)29)11-15(10-13)32-19-8-6-5-7-18(19)30-3/h5-12H,4H2,1-3H3,(H,22,26)