3-[5-methoxy-2-(2-naphthalen-2-ylethoxy)-4-(pyrazol-1-ylmethyl)phenyl]propanoic acid

Systemtic Name: 3-[5-methoxy-2-(2-naphthalen-2-ylethoxy)-4-(pyrazol-1-ylmethyl)phenyl]propanoic acid Openeye Name: 3-[5-methoxy-2-[2-(2-naphthyl)ethoxy]-4-(pyrazol-1-ylmethyl)phenyl]propanoic acid CAS Name: 3-[5-methoxy-2-[2-(2-naphthalenyl)ethoxy]-4-(1-pyrazolylmethyl)phenyl]propanoic acid IUPAC Name: 3-[5-methoxy-2-(2-naphthalen-2-ylethoxy)-4-(pyrazol-1-ylmethyl)phenyl]propanoic acid Traditional Name: 3-[5-methoxy-2-[2-(2-naphthyl)ethoxy]-4-(pyrazol-1-ylmethyl)phenyl]propionic acid Formula: C26H26N2O4 MolecularWeight: 430.49564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCC(=O)O)OCCC2=CC3=CC=CC=C3C=C2)CN4C=CC=N4

Isomeric SMILES

COC1=C(C=C(C(=C1)CCC(=O)O)OCCC2=CC3=CC=CC=C3C=C2)CN4C=CC=N4

InChI

InChI=1S/C26H26N2O4/c1-31-24-16-22(9-10-26(29)30)25(17-23(24)18-28-13-4-12-27-28)32-14-11-19-7-8-20-5-2-3-6-21(20)15-19/h2-8,12-13,15-17H,9-11,14,18H2,1H3,(H,29,30)