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

Systemtic Name: N-tert-butyl-4-[2-(6-fluoranyl-4H-1,3-benzodioxin-8-yl)ethylcarbamoylamino]benzamide Openeye Name: N-tert-butyl-4-[2-(6-fluoro-4H-1,3-benzodioxin-8-yl)ethylcarbamoylamino]benzamide CAS Name: N-tert-butyl-4-[[[2-(6-fluoro-4H-1,3-benzodioxin-8-yl)ethylamino]-oxomethyl]amino]benzamide IUPAC Name: N-tert-butyl-4-[2-(6-fluoro-4H-1,3-benzodioxin-8-yl)ethylcarbamoylamino]benzamide Traditional Name: N-tert-butyl-4-[2-(6-fluoro-4H-1,3-benzodioxin-8-yl)ethylcarbamoylamino]benzamide Formula: C22H26FN3O4 MolecularWeight: 415.457943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26FN3O4/c1-22(2,3)26-20(27)14-4-6-18(7-5-14)25-21(28)24-9-8-15-10-17(23)11-16-12-29-13-30-19(15)16/h4-7,10-11H,8-9,12-13H2,1-3H3,(H,26,27)(H2,24,25,28)