2-[3,5-bis(3-methoxyphenyl)-1-phenyl-pyrazol-4-yl]ethanoic acid

Systemtic Name: 2-[3,5-bis(3-methoxyphenyl)-1-phenyl-pyrazol-4-yl]ethanoic acid Openeye Name: 2-[3,5-bis(3-methoxyphenyl)-1-phenyl-pyrazol-4-yl]acetic acid CAS Name: 2-[3,5-bis(3-methoxyphenyl)-1-phenyl-4-pyrazolyl]acetic acid IUPAC Name: 2-[3,5-bis(3-methoxyphenyl)-1-phenylpyrazol-4-yl]acetic acid Traditional Name: 2-[3,5-bis(3-methoxyphenyl)-1-phenyl-pyrazol-4-yl]acetic acid Formula: C25H22N2O4 MolecularWeight: 414.45318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C(C(=NN2C3=CC=CC=C3)C4=CC(=CC=C4)OC)CC(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C2=C(C(=NN2C3=CC=CC=C3)C4=CC(=CC=C4)OC)CC(=O)O

InChI

InChI=1S/C25H22N2O4/c1-30-20-12-6-8-17(14-20)24-22(16-23(28)29)25(18-9-7-13-21(15-18)31-2)27(26-24)19-10-4-3-5-11-19/h3-15H,16H2,1-2H3,(H,28,29)