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

Systemtic Name: methyl 3-methyl-2-(4-nitrophenyl)-5-phenyl-4H-pyrazole-3-carboxylate Openeye Name: methyl 3-methyl-2-(4-nitrophenyl)-5-phenyl-4H-pyrazole-3-carboxylate CAS Name: 3-methyl-2-(4-nitrophenyl)-5-phenyl-4H-pyrazole-3-carboxylic acid methyl ester IUPAC Name: methyl 3-methyl-2-(4-nitrophenyl)-5-phenyl-4H-pyrazole-3-carboxylate Traditional Name: 3-methyl-2-(4-nitrophenyl)-5-phenyl-2-pyrazoline-3-carboxylic acid methyl ester Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3O4/c1-18(17(22)25-2)12-16(13-6-4-3-5-7-13)19-20(18)14-8-10-15(11-9-14)21(23)24/h3-11H,12H2,1-2H3