2-[3-[2-(4,5-diphenylpyrazol-1-yl)ethyl]phenoxy]ethanoic acid

Systemtic Name: 2-[3-[2-(4,5-diphenylpyrazol-1-yl)ethyl]phenoxy]ethanoic acid Openeye Name: 2-[3-[2-(4,5-diphenylpyrazol-1-yl)ethyl]phenoxy]acetic acid CAS Name: 2-[3-[2-(4,5-diphenyl-1-pyrazolyl)ethyl]phenoxy]acetic acid IUPAC Name: 2-[3-[2-(4,5-diphenylpyrazol-1-yl)ethyl]phenoxy]acetic acid Traditional Name: 2-[3-[2-(4,5-diphenylpyrazol-1-yl)ethyl]phenoxy]acetic acid Formula: C25H22N2O3 MolecularWeight: 398.45378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N(N=C2)CCC3=CC(=CC=C3)OCC(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N(N=C2)CCC3=CC(=CC=C3)OCC(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C25H22N2O3/c28-24(29)18-30-22-13-7-8-19(16-22)14-15-27-25(21-11-5-2-6-12-21)23(17-26-27)20-9-3-1-4-10-20/h1-13,16-17H,14-15,18H2,(H,28,29)