2-[2-(6-fluoranyl-4H-1,3-benzodioxin-8-yl)ethylcarbamoylamino]-N,N-dimethyl-benzamide

Systemtic Name: 2-[2-(6-fluoranyl-4H-1,3-benzodioxin-8-yl)ethylcarbamoylamino]-N,N-dimethyl-benzamide Openeye Name: 2-[2-(6-fluoro-4H-1,3-benzodioxin-8-yl)ethylcarbamoylamino]-N,N-dimethyl-benzamide CAS Name: 2-[[[2-(6-fluoro-4H-1,3-benzodioxin-8-yl)ethylamino]-oxomethyl]amino]-N,N-dimethylbenzamide IUPAC Name: 2-[2-(6-fluoro-4H-1,3-benzodioxin-8-yl)ethylcarbamoylamino]-N,N-dimethylbenzamide Traditional Name: 2-[2-(6-fluoro-4H-1,3-benzodioxin-8-yl)ethylcarbamoylamino]-N,N-dimethyl-benzamide Formula: C20H22FN3O4 MolecularWeight: 387.404783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC=CC=C1NC(=O)NCCC2=C3C(=CC(=C2)F)COCO3

Isomeric SMILES

CN(C)C(=O)C1=CC=CC=C1NC(=O)NCCC2=C3C(=CC(=C2)F)COCO3

InChI

InChI=1S/C20H22FN3O4/c1-24(2)19(25)16-5-3-4-6-17(16)23-20(26)22-8-7-13-9-15(21)10-14-11-27-12-28-18(13)14/h3-6,9-10H,7-8,11-12H2,1-2H3,(H2,22,23,26)