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

Systemtic Name: 5-ethyl-1-(4-methoxyphenyl)-3-(4-phenylphenyl)pyrazole-4-carboxylic acid Openeye Name: 5-ethyl-1-(4-methoxyphenyl)-3-(4-phenylphenyl)pyrazole-4-carboxylic acid CAS Name: 5-ethyl-1-(4-methoxyphenyl)-3-(4-phenylphenyl)-4-pyrazolecarboxylic acid IUPAC Name: 5-ethyl-1-(4-methoxyphenyl)-3-(4-phenylphenyl)pyrazole-4-carboxylic acid Traditional Name: 5-ethyl-1-(4-methoxyphenyl)-3-(4-phenylphenyl)pyrazole-4-carboxylic acid Formula: C25H22N2O3 MolecularWeight: 398.45378

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1C2=CC=C(C=C2)OC)C3=CC=C(C=C3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CCC1=C(C(=NN1C2=CC=C(C=C2)OC)C3=CC=C(C=C3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C25H22N2O3/c1-3-22-23(25(28)29)24(26-27(22)20-13-15-21(30-2)16-14-20)19-11-9-18(10-12-19)17-7-5-4-6-8-17/h4-16H,3H2,1-2H3,(H,28,29)