N-[[3-[2-(6-fluoranyl-4H-1,3-benzodioxin-8-yl)ethylcarbamoylamino]phenyl]methyl]-N-methyl-ethanamide

Systemtic Name: N-[[3-[2-(6-fluoranyl-4H-1,3-benzodioxin-8-yl)ethylcarbamoylamino]phenyl]methyl]-N-methyl-ethanamide Openeye Name: N-[[3-[2-(6-fluoro-4H-1,3-benzodioxin-8-yl)ethylcarbamoylamino]phenyl]methyl]-N-methyl-acetamide CAS Name: N-[[3-[[[2-(6-fluoro-4H-1,3-benzodioxin-8-yl)ethylamino]-oxomethyl]amino]phenyl]methyl]-N-methylacetamide IUPAC Name: N-[[3-[2-(6-fluoro-4H-1,3-benzodioxin-8-yl)ethylcarbamoylamino]phenyl]methyl]-N-methylacetamide Traditional Name: N-[3-[2-(6-fluoro-4H-1,3-benzodioxin-8-yl)ethylcarbamoylamino]benzyl]-N-methyl-acetamide Formula: C21H24FN3O4 MolecularWeight: 401.431363

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C)CC1=CC(=CC=C1)NC(=O)NCCC2=C3C(=CC(=C2)F)COCO3

Isomeric SMILES

CC(=O)N(C)CC1=CC(=CC=C1)NC(=O)NCCC2=C3C(=CC(=C2)F)COCO3

InChI

InChI=1S/C21H24FN3O4/c1-14(26)25(2)11-15-4-3-5-19(8-15)24-21(27)23-7-6-16-9-18(22)10-17-12-28-13-29-20(16)17/h3-5,8-10H,6-7,11-13H2,1-2H3,(H2,23,24,27)