1-(4-methoxyphenyl)-3-(4-phenylphenyl)-5-propyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-(4-methoxyphenyl)-3-(4-phenylphenyl)-5-propyl-pyrazole-4-carboxylic acid Openeye Name: 1-(4-methoxyphenyl)-3-(4-phenylphenyl)-5-propyl-pyrazole-4-carboxylic acid CAS Name: 1-(4-methoxyphenyl)-3-(4-phenylphenyl)-5-propyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(4-methoxyphenyl)-3-(4-phenylphenyl)-5-propylpyrazole-4-carboxylic acid Traditional Name: 1-(4-methoxyphenyl)-3-(4-phenylphenyl)-5-propyl-pyrazole-4-carboxylic acid Formula: C26H24N2O3 MolecularWeight: 412.48036

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=NN1C2=CC=C(C=C2)OC)C3=CC=C(C=C3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CCCC1=C(C(=NN1C2=CC=C(C=C2)OC)C3=CC=C(C=C3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C26H24N2O3/c1-3-7-23-24(26(29)30)25(27-28(23)21-14-16-22(31-2)17-15-21)20-12-10-19(11-13-20)18-8-5-4-6-9-18/h4-6,8-17H,3,7H2,1-2H3,(H,29,30)