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

Systemtic Name: 3-fluoranyl-N-[6-[4-(2-oxidanyl-3-prop-2-enoxy-propyl)piperazin-1-yl]pyridin-3-yl]benzamide Openeye Name: N-[6-[4-(3-allyloxy-2-hydroxy-propyl)piperazin-1-yl]-3-pyridyl]-3-fluoro-benzamide CAS Name: 3-fluoro-N-[6-[4-(2-hydroxy-3-prop-2-enoxypropyl)-1-piperazinyl]-3-pyridinyl]benzamide IUPAC Name: 3-fluoro-N-[6-[4-(2-hydroxy-3-prop-2-enoxypropyl)piperazin-1-yl]pyridin-3-yl]benzamide Traditional Name: N-[6-[4-(3-allyloxy-2-hydroxy-propyl)piperazino]-3-pyridyl]-3-fluoro-benzamide Formula: C22H27FN4O3 MolecularWeight: 414.473183

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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)F)O

Isomeric SMILES

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

InChI

InChI=1S/C22H27FN4O3/c1-2-12-30-16-20(28)15-26-8-10-27(11-9-26)21-7-6-19(14-24-21)25-22(29)17-4-3-5-18(23)13-17/h2-7,13-14,20,28H,1,8-12,15-16H2,(H,25,29)