2-[(2-methyl-4-phenylmethoxy-phenyl)methyl]-3-(trifluoromethyl)-1H-pyrazol-5-one

Systemtic Name: 2-[(2-methyl-4-phenylmethoxy-phenyl)methyl]-3-(trifluoromethyl)-1H-pyrazol-5-one Openeye Name: 2-[(4-benzyloxy-2-methyl-phenyl)methyl]-3-(trifluoromethyl)-1H-pyrazol-5-one CAS Name: 2-[(2-methyl-4-phenylmethoxyphenyl)methyl]-3-(trifluoromethyl)-1H-pyrazol-5-one IUPAC Name: 2-[(2-methyl-4-phenylmethoxyphenyl)methyl]-3-(trifluoromethyl)-1H-pyrazol-5-one Traditional Name: 1-(4-benzoxy-2-methyl-benzyl)-5-(trifluoromethyl)-3-pyrazolin-3-one Formula: C19H17F3N2O2 MolecularWeight: 362.34569

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=CC=CC=C2)CN3C(=CC(=O)N3)C(F)(F)F

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=CC=CC=C2)CN3C(=CC(=O)N3)C(F)(F)F

InChI

InChI=1S/C19H17F3N2O2/c1-13-9-16(26-12-14-5-3-2-4-6-14)8-7-15(13)11-24-17(19(20,21)22)10-18(25)23-24/h2-10H,11-12H2,1H3,(H,23,25)