N-[[(2S)-butan-2-yl]carbamoyl]-2-(5-fluoranyl-2-nitro-phenoxy)ethanamide

Systemtic Name: N-[[(2S)-butan-2-yl]carbamoyl]-2-(5-fluoranyl-2-nitro-phenoxy)ethanamide Openeye Name: 2-(5-fluoro-2-nitro-phenoxy)-N-[[(1S)-1-methylpropyl]carbamoyl]acetamide CAS Name: N-[[[(2S)-butan-2-yl]amino]-oxomethyl]-2-(5-fluoro-2-nitrophenoxy)acetamide IUPAC Name: N-[[(2S)-butan-2-yl]carbamoyl]-2-(5-fluoro-2-nitrophenoxy)acetamide Traditional Name: 2-(5-fluoro-2-nitro-phenoxy)-N-[[(1S)-1-methylpropyl]carbamoyl]acetamide Formula: C13H16FN3O5 MolecularWeight: 313.281643

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC(=O)COC1=C(C=CC(=C1)F)[N+](=O)[O-]

Isomeric SMILES

CC[C@H](C)NC(=O)NC(=O)COC1=C(C=CC(=C1)F)[N+](=O)[O-]

InChI

InChI=1S/C13H16FN3O5/c1-3-8(2)15-13(19)16-12(18)7-22-11-6-9(14)4-5-10(11)17(20)21/h4-6,8H,3,7H2,1-2H3,(H2,15,16,18,19)/t8-/m0/s1