4-[(2-chlorophenyl)methyl]-5-methyl-2-[5-(trifluoromethyl)pyridin-2-yl]-1H-pyrazol-3-one

Systemtic Name: 4-[(2-chlorophenyl)methyl]-5-methyl-2-[5-(trifluoromethyl)pyridin-2-yl]-1H-pyrazol-3-one Openeye Name: 4-[(2-chlorophenyl)methyl]-5-methyl-2-[5-(trifluoromethyl)-2-pyridyl]-1H-pyrazol-3-one CAS Name: 4-[(2-chlorophenyl)methyl]-5-methyl-2-[5-(trifluoromethyl)-2-pyridinyl]-1H-pyrazol-3-one IUPAC Name: 4-[(2-chlorophenyl)methyl]-5-methyl-2-[5-(trifluoromethyl)pyridin-2-yl]-1H-pyrazol-3-one Traditional Name: 4-(2-chlorobenzyl)-5-methyl-2-[5-(trifluoromethyl)-2-pyridyl]-3-pyrazolin-3-one Formula: C17H13ClF3N3O MolecularWeight: 367.75283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=NC=C(C=C2)C(F)(F)F)CC3=CC=CC=C3Cl

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=NC=C(C=C2)C(F)(F)F)CC3=CC=CC=C3Cl

InChI

InChI=1S/C17H13ClF3N3O/c1-10-13(8-11-4-2-3-5-14(11)18)16(25)24(23-10)15-7-6-12(9-22-15)17(19,20)21/h2-7,9,23H,8H2,1H3