(4-hexylphenyl)-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methanone

Systemtic Name: (4-hexylphenyl)-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methanone Openeye Name: (4-hexylphenyl)-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]methanone CAS Name: (4-hexylphenyl)-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]methanone IUPAC Name: (4-hexylphenyl)-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methanone Traditional Name: (4-hexylphenyl)-[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]methanone Formula: C23H28F3N3O MolecularWeight: 419.48313

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C23H28F3N3O/c1-2-3-4-5-6-18-7-9-19(10-8-18)22(30)29-15-13-28(14-16-29)21-12-11-20(17-27-21)23(24,25)26/h7-12,17H,2-6,13-16H2,1H3