ethyl 1-[3-[(4,5-dimethoxy-2-nitro-phenyl)carbonylamino]phenyl]-5-methyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[3-[(4,5-dimethoxy-2-nitro-phenyl)carbonylamino]phenyl]-5-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-[3-[(4,5-dimethoxy-2-nitro-benzoyl)amino]phenyl]-5-methyl-pyrazole-4-carboxylate CAS Name: 1-[3-[[(4,5-dimethoxy-2-nitrophenyl)-oxomethyl]amino]phenyl]-5-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[(4,5-dimethoxy-2-nitrobenzoyl)amino]phenyl]-5-methylpyrazole-4-carboxylate Traditional Name: 1-[3-[(4,5-dimethoxy-2-nitro-benzoyl)amino]phenyl]-5-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C22H22N4O7 MolecularWeight: 454.43268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)NC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)NC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC)C

InChI

InChI=1S/C22H22N4O7/c1-5-33-22(28)17-12-23-25(13(17)2)15-8-6-7-14(9-15)24-21(27)16-10-19(31-3)20(32-4)11-18(16)26(29)30/h6-12H,5H2,1-4H3,(H,24,27)