4-[2-(2-naphthalen-2-ylethoxy)-4-(pyrazol-1-ylmethyl)phenyl]butanoic acid

Systemtic Name: 4-[2-(2-naphthalen-2-ylethoxy)-4-(pyrazol-1-ylmethyl)phenyl]butanoic acid Openeye Name: 4-[2-[2-(2-naphthyl)ethoxy]-4-(pyrazol-1-ylmethyl)phenyl]butanoic acid CAS Name: 4-[2-[2-(2-naphthalenyl)ethoxy]-4-(1-pyrazolylmethyl)phenyl]butanoic acid IUPAC Name: 4-[2-(2-naphthalen-2-ylethoxy)-4-(pyrazol-1-ylmethyl)phenyl]butanoic acid Traditional Name: 4-[2-[2-(2-naphthyl)ethoxy]-4-(pyrazol-1-ylmethyl)phenyl]butyric acid Formula: C26H26N2O3 MolecularWeight: 414.49624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CCOC3=C(C=CC(=C3)CN4C=CC=N4)CCCC(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)CCOC3=C(C=CC(=C3)CN4C=CC=N4)CCCC(=O)O

InChI

InChI=1S/C26H26N2O3/c29-26(30)8-3-7-23-12-10-21(19-28-15-4-14-27-28)18-25(23)31-16-13-20-9-11-22-5-1-2-6-24(22)17-20/h1-2,4-6,9-12,14-15,17-18H,3,7-8,13,16,19H2,(H,29,30)