(4-methyl-2-oxidanyl-phenyl)-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methanone

Systemtic Name: (4-methyl-2-oxidanyl-phenyl)-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methanone Openeye Name: (2-hydroxy-4-methyl-phenyl)-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]methanone CAS Name: (2-hydroxy-4-methylphenyl)-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]methanone IUPAC Name: (2-hydroxy-4-methylphenyl)-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methanone Traditional Name: (2-hydroxy-4-methyl-phenyl)-[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]methanone Formula: C18H18F3N3O2 MolecularWeight: 365.34963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)N2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)N2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F)O

InChI

InChI=1S/C18H18F3N3O2/c1-12-2-4-14(15(25)10-12)17(26)24-8-6-23(7-9-24)16-5-3-13(11-22-16)18(19,20)21/h2-5,10-11,25H,6-9H2,1H3