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

Systemtic Name: ethyl 5-[(2-methyl-3-nitro-phenyl)carbonylamino]-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[(2-methyl-3-nitro-benzoyl)amino]-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-[[(2-methyl-3-nitrophenyl)-oxomethyl]amino]-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(2-methyl-3-nitrobenzoyl)amino]-1-phenylpyrazole-4-carboxylate Traditional Name: 5-[(2-methyl-3-nitro-benzoyl)amino]-1-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C20H18N4O5 MolecularWeight: 394.38072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18N4O5/c1-3-29-20(26)16-12-21-23(14-8-5-4-6-9-14)18(16)22-19(25)15-10-7-11-17(13(15)2)24(27)28/h4-12H,3H2,1-2H3,(H,22,25)