5-(3,4-dimethylphenyl)-2-(4-nitrophenyl)pyrazole-3-carboxylate

Systemtic Name: 5-(3,4-dimethylphenyl)-2-(4-nitrophenyl)pyrazole-3-carboxylate Openeye Name: 5-(3,4-dimethylphenyl)-2-(4-nitrophenyl)pyrazole-3-carboxylate CAS Name: 5-(3,4-dimethylphenyl)-2-(4-nitrophenyl)-3-pyrazolecarboxylate IUPAC Name: 5-(3,4-dimethylphenyl)-2-(4-nitrophenyl)pyrazole-3-carboxylate Traditional Name: 5-(3,4-dimethylphenyl)-2-(4-nitrophenyl)pyrazole-3-carboxylate Formula: C18H14N3O4- MolecularWeight: 336.32146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=C2)C(=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=C2)C(=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C18H15N3O4/c1-11-3-4-13(9-12(11)2)16-10-17(18(22)23)20(19-16)14-5-7-15(8-6-14)21(24)25/h3-10H,1-2H3,(H,22,23)/p-1