ethyl 4-(4-chlorophenyl)carbonyl-1-(3-nitrophenyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 4-(4-chlorophenyl)carbonyl-1-(3-nitrophenyl)pyrazole-3-carboxylate Openeye Name: ethyl 4-(4-chlorobenzoyl)-1-(3-nitrophenyl)pyrazole-3-carboxylate CAS Name: 4-[(4-chlorophenyl)-oxomethyl]-1-(3-nitrophenyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorobenzoyl)-1-(3-nitrophenyl)pyrazole-3-carboxylate Traditional Name: 4-(4-chlorobenzoyl)-1-(3-nitrophenyl)pyrazole-3-carboxylic acid ethyl ester Formula: C19H14ClN3O5 MolecularWeight: 399.78456

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C=C1C(=O)C2=CC=C(C=C2)Cl)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=NN(C=C1C(=O)C2=CC=C(C=C2)Cl)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H14ClN3O5/c1-2-28-19(25)17-16(18(24)12-6-8-13(20)9-7-12)11-22(21-17)14-4-3-5-15(10-14)23(26)27/h3-11H,2H2,1H3