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

Systemtic Name: 2-[3-[2-(1,5-diphenylpyrazol-3-yl)ethyl]phenoxy]ethanoic acid Openeye Name: 2-[3-[2-(1,5-diphenylpyrazol-3-yl)ethyl]phenoxy]acetic acid CAS Name: 2-[3-[2-(1,5-diphenyl-3-pyrazolyl)ethyl]phenoxy]acetic acid IUPAC Name: 2-[3-[2-(1,5-diphenylpyrazol-3-yl)ethyl]phenoxy]acetic acid Traditional Name: 2-[3-[2-(1,5-diphenylpyrazol-3-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=CC(=NN2C3=CC=CC=C3)CCC4=CC(=CC=C4)OCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NN2C3=CC=CC=C3)CCC4=CC(=CC=C4)OCC(=O)O

InChI

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