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

Systemtic Name: 3-[2-[2-(3-piperidin-1-ylphenyl)ethoxy]-4-(pyrazol-1-ylmethyl)phenyl]propanoic acid Openeye Name: 3-[2-[2-[3-(1-piperidyl)phenyl]ethoxy]-4-(pyrazol-1-ylmethyl)phenyl]propanoic acid CAS Name: 3-[2-[2-[3-(1-piperidinyl)phenyl]ethoxy]-4-(1-pyrazolylmethyl)phenyl]propanoic acid IUPAC Name: 3-[2-[2-(3-piperidin-1-ylphenyl)ethoxy]-4-(pyrazol-1-ylmethyl)phenyl]propanoic acid Traditional Name: 3-[2-[2-(3-piperidinophenyl)ethoxy]-4-(pyrazol-1-ylmethyl)phenyl]propionic acid Formula: C26H31N3O3 MolecularWeight: 433.54264

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=CC(=C2)CCOC3=C(C=CC(=C3)CN4C=CC=N4)CCC(=O)O

Isomeric SMILES

C1CCN(CC1)C2=CC=CC(=C2)CCOC3=C(C=CC(=C3)CN4C=CC=N4)CCC(=O)O

InChI

InChI=1S/C26H31N3O3/c30-26(31)11-10-23-9-8-22(20-29-16-5-13-27-29)19-25(23)32-17-12-21-6-4-7-24(18-21)28-14-2-1-3-15-28/h4-9,13,16,18-19H,1-3,10-12,14-15,17,20H2,(H,30,31)