N-[6-[4-(3-methoxy-2-oxidanyl-propyl)piperazin-1-yl]pyridin-3-yl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[6-[4-(3-methoxy-2-oxidanyl-propyl)piperazin-1-yl]pyridin-3-yl]-3-(trifluoromethyl)benzamide Openeye Name: N-[6-[4-(2-hydroxy-3-methoxy-propyl)piperazin-1-yl]-3-pyridyl]-3-(trifluoromethyl)benzamide CAS Name: N-[6-[4-(2-hydroxy-3-methoxypropyl)-1-piperazinyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[6-[4-(2-hydroxy-3-methoxypropyl)piperazin-1-yl]pyridin-3-yl]-3-(trifluoromethyl)benzamide Traditional Name: N-[6-[4-(2-hydroxy-3-methoxy-propyl)piperazino]-3-pyridyl]-3-(trifluoromethyl)benzamide Formula: C21H25F3N4O3 MolecularWeight: 438.44341

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Descriptors Computed from Structure

Canonical SMILES:

COCC(CN1CCN(CC1)C2=NC=C(C=C2)NC(=O)C3=CC(=CC=C3)C(F)(F)F)O

Isomeric SMILES

COCC(CN1CCN(CC1)C2=NC=C(C=C2)NC(=O)C3=CC(=CC=C3)C(F)(F)F)O

InChI

InChI=1S/C21H25F3N4O3/c1-31-14-18(29)13-27-7-9-28(10-8-27)19-6-5-17(12-25-19)26-20(30)15-3-2-4-16(11-15)21(22,23)24/h2-6,11-12,18,29H,7-10,13-14H2,1H3,(H,26,30)