5-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: 5-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-3-carboxylate Openeye Name: 5-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-3-carboxylate CAS Name: 5-(3,4-dimethoxyphenyl)-1-phenyl-3-pyrazolecarboxylate IUPAC Name: 5-(3,4-dimethoxyphenyl)-1-phenylpyrazole-3-carboxylate Traditional Name: 5-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-3-carboxylate Formula: C18H15N2O4- MolecularWeight: 323.3227

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=NN2C3=CC=CC=C3)C(=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=NN2C3=CC=CC=C3)C(=O)[O-])OC

InChI

InChI=1S/C18H16N2O4/c1-23-16-9-8-12(10-17(16)24-2)15-11-14(18(21)22)19-20(15)13-6-4-3-5-7-13/h3-11H,1-2H3,(H,21,22)/p-1