[phenyl(pyridin-3-yl)methyl] 2-phenoxy-2-pyrazol-1-yl-butanoate

Systemtic Name: [phenyl(pyridin-3-yl)methyl] 2-phenoxy-2-pyrazol-1-yl-butanoate Openeye Name: [phenyl(3-pyridyl)methyl] 2-phenoxy-2-pyrazol-1-yl-butanoate CAS Name: 2-phenoxy-2-(1-pyrazolyl)butanoic acid [phenyl(3-pyridinyl)methyl] ester IUPAC Name: [phenyl(pyridin-3-yl)methyl] 2-phenoxy-2-pyrazol-1-ylbutanoate Traditional Name: 2-phenoxy-2-pyrazol-1-yl-butyric acid [phenyl(3-pyridyl)methyl] ester Formula: C25H23N3O3 MolecularWeight: 413.46842

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC(C1=CC=CC=C1)C2=CN=CC=C2)(N3C=CC=N3)OC4=CC=CC=C4

Isomeric SMILES

CCC(C(=O)OC(C1=CC=CC=C1)C2=CN=CC=C2)(N3C=CC=N3)OC4=CC=CC=C4

InChI

InChI=1S/C25H23N3O3/c1-2-25(28-18-10-17-27-28,31-22-14-7-4-8-15-22)24(29)30-23(20-11-5-3-6-12-20)21-13-9-16-26-19-21/h3-19,23H,2H2,1H3