3-[2-[2-(2-phenylphenyl)ethoxy]-4-(pyrazol-1-ylmethyl)phenyl]propanoic acid

Systemtic Name: 3-[2-[2-(2-phenylphenyl)ethoxy]-4-(pyrazol-1-ylmethyl)phenyl]propanoic acid Openeye Name: 3-[2-[2-(2-phenylphenyl)ethoxy]-4-(pyrazol-1-ylmethyl)phenyl]propanoic acid CAS Name: 3-[2-[2-(2-phenylphenyl)ethoxy]-4-(1-pyrazolylmethyl)phenyl]propanoic acid IUPAC Name: 3-[2-[2-(2-phenylphenyl)ethoxy]-4-(pyrazol-1-ylmethyl)phenyl]propanoic acid Traditional Name: 3-[2-[2-(2-phenylphenyl)ethoxy]-4-(pyrazol-1-ylmethyl)phenyl]propionic acid Formula: C27H26N2O3 MolecularWeight: 426.50694

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=CC=C2CCOC3=C(C=CC(=C3)CN4C=CC=N4)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=CC=C2CCOC3=C(C=CC(=C3)CN4C=CC=N4)CCC(=O)O

InChI

InChI=1S/C27H26N2O3/c30-27(31)14-13-24-12-11-21(20-29-17-6-16-28-29)19-26(24)32-18-15-23-9-4-5-10-25(23)22-7-2-1-3-8-22/h1-12,16-17,19H,13-15,18,20H2,(H,30,31)