N-[(2S,3R)-3-azanyl-1-(oxidanylamino)-1-oxidanylidene-butan-2-yl]-4-but-2-ynoxy-2-fluoranyl-benzamide

Systemtic Name: N-[(2S,3R)-3-azanyl-1-(oxidanylamino)-1-oxidanylidene-butan-2-yl]-4-but-2-ynoxy-2-fluoranyl-benzamide Openeye Name: N-[(1S,2R)-2-amino-1-(hydroxycarbamoyl)propyl]-4-but-2-ynoxy-2-fluoro-benzamide CAS Name: N-[(2S,3R)-3-amino-1-(hydroxyamino)-1-oxobutan-2-yl]-4-but-2-ynoxy-2-fluorobenzamide IUPAC Name: N-[(2S,3R)-3-amino-1-(hydroxyamino)-1-oxobutan-2-yl]-4-but-2-ynoxy-2-fluorobenzamide Traditional Name: N-[(1S,2R)-2-amino-1-(hydroxycarbamoyl)propyl]-4-but-2-ynoxy-2-fluoro-benzamide Formula: C15H18FN3O4 MolecularWeight: 323.319523

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC(=C(C=C1)C(=O)NC(C(C)N)C(=O)NO)F

Isomeric SMILES

CC#CCOC1=CC(=C(C=C1)C(=O)N[C@@H]([C@@H](C)N)C(=O)NO)F

InChI

InChI=1S/C15H18FN3O4/c1-3-4-7-23-10-5-6-11(12(16)8-10)14(20)18-13(9(2)17)15(21)19-22/h5-6,8-9,13,22H,7,17H2,1-2H3,(H,18,20)(H,19,21)/t9-,13+/m1/s1