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

Systemtic Name: ethyl 5-methyl-1-[3-[(2-methyl-3-nitro-phenyl)carbonylamino]phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-methyl-1-[3-[(2-methyl-3-nitro-benzoyl)amino]phenyl]pyrazole-4-carboxylate CAS Name: 5-methyl-1-[3-[[(2-methyl-3-nitrophenyl)-oxomethyl]amino]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-1-[3-[(2-methyl-3-nitrobenzoyl)amino]phenyl]pyrazole-4-carboxylate Traditional Name: 5-methyl-1-[3-[(2-methyl-3-nitro-benzoyl)amino]phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C21H20N4O5 MolecularWeight: 408.4073

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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)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)C

InChI

InChI=1S/C21H20N4O5/c1-4-30-21(27)18-12-22-24(14(18)3)16-8-5-7-15(11-16)23-20(26)17-9-6-10-19(13(17)2)25(28)29/h5-12H,4H2,1-3H3,(H,23,26)