5-(4-ethylphenyl)-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: 5-(4-ethylphenyl)-1-phenyl-pyrazole-3-carboxylate Openeye Name: 5-(4-ethylphenyl)-1-phenyl-pyrazole-3-carboxylate CAS Name: 5-(4-ethylphenyl)-1-phenyl-3-pyrazolecarboxylate IUPAC Name: 5-(4-ethylphenyl)-1-phenylpyrazole-3-carboxylate Traditional Name: 5-(4-ethylphenyl)-1-phenyl-pyrazole-3-carboxylate Formula: C18H15N2O2- MolecularWeight: 291.3239

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CC(=NN2C3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CC(=NN2C3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C18H16N2O2/c1-2-13-8-10-14(11-9-13)17-12-16(18(21)22)19-20(17)15-6-4-3-5-7-15/h3-12H,2H2,1H3,(H,21,22)/p-1