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

Systemtic Name: N-[6-[4-(2-oxidanyl-3-prop-2-enoxy-propyl)piperazin-1-yl]pyridin-3-yl]-3-(trifluoromethyl)benzamide Openeye Name: N-[6-[4-(3-allyloxy-2-hydroxy-propyl)piperazin-1-yl]-3-pyridyl]-3-(trifluoromethyl)benzamide CAS Name: N-[6-[4-(2-hydroxy-3-prop-2-enoxypropyl)-1-piperazinyl]-3-pyridinyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[6-[4-(2-hydroxy-3-prop-2-enoxypropyl)piperazin-1-yl]pyridin-3-yl]-3-(trifluoromethyl)benzamide Traditional Name: N-[6-[4-(3-allyloxy-2-hydroxy-propyl)piperazino]-3-pyridyl]-3-(trifluoromethyl)benzamide Formula: C23H27F3N4O3 MolecularWeight: 464.48069

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27F3N4O3/c1-2-12-33-16-20(31)15-29-8-10-30(11-9-29)21-7-6-19(14-27-21)28-22(32)17-4-3-5-18(13-17)23(24,25)26/h2-7,13-14,20,31H,1,8-12,15-16H2,(H,28,32)