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

Systemtic Name: ethyl 5-methyl-1-[3-[(4-nitrophenyl)carbonylamino]phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-methyl-1-[3-[(4-nitrobenzoyl)amino]phenyl]pyrazole-4-carboxylate CAS Name: 5-methyl-1-[3-[[(4-nitrophenyl)-oxomethyl]amino]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-1-[3-[(4-nitrobenzoyl)amino]phenyl]pyrazole-4-carboxylate Traditional Name: 5-methyl-1-[3-[(4-nitrobenzoyl)amino]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=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

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

InChI

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