methyl 5-(4-chlorophenyl)-3-methyl-2-(4-nitrophenyl)-4H-pyrazole-3-carboxylate

Systemtic Name: methyl 5-(4-chlorophenyl)-3-methyl-2-(4-nitrophenyl)-4H-pyrazole-3-carboxylate Openeye Name: methyl 5-(4-chlorophenyl)-3-methyl-2-(4-nitrophenyl)-4H-pyrazole-3-carboxylate CAS Name: 5-(4-chlorophenyl)-3-methyl-2-(4-nitrophenyl)-4H-pyrazole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-(4-chlorophenyl)-3-methyl-2-(4-nitrophenyl)-4H-pyrazole-3-carboxylate Traditional Name: 5-(4-chlorophenyl)-3-methyl-2-(4-nitrophenyl)-2-pyrazoline-3-carboxylic acid methyl ester Formula: C18H16ClN3O4 MolecularWeight: 373.79034

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)Cl)C(=O)OC

Isomeric SMILES

CC1(CC(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)Cl)C(=O)OC

InChI

InChI=1S/C18H16ClN3O4/c1-18(17(23)26-2)11-16(12-3-5-13(19)6-4-12)20-21(18)14-7-9-15(10-8-14)22(24)25/h3-10H,11H2,1-2H3