N-[2-[[(2S)-butan-2-yl]amino]-2-oxidanylidene-ethyl]-4-fluoranyl-benzamide

Systemtic Name: N-[2-[[(2S)-butan-2-yl]amino]-2-oxidanylidene-ethyl]-4-fluoranyl-benzamide Openeye Name: 4-fluoro-N-[2-[[(1S)-1-methylpropyl]amino]-2-oxo-ethyl]benzamide CAS Name: N-[2-[[(2S)-butan-2-yl]amino]-2-oxoethyl]-4-fluorobenzamide IUPAC Name: N-[2-[[(2S)-butan-2-yl]amino]-2-oxoethyl]-4-fluorobenzamide Traditional Name: 4-fluoro-N-[2-keto-2-[[(1S)-1-methylpropyl]amino]ethyl]benzamide Formula: C13H17FN2O2 MolecularWeight: 252.284683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CNC(=O)C1=CC=C(C=C1)F

Isomeric SMILES

CC[C@H](C)NC(=O)CNC(=O)C1=CC=C(C=C1)F

InChI

InChI=1S/C13H17FN2O2/c1-3-9(2)16-12(17)8-15-13(18)10-4-6-11(14)7-5-10/h4-7,9H,3,8H2,1-2H3,(H,15,18)(H,16,17)/t9-/m0/s1