ethanoyl fluoride; 6-pyrrolidin-3-ylsulfonyl-3H-1,3-benzoxazol-2-one

Systemtic Name: ethanoyl fluoride; 6-pyrrolidin-3-ylsulfonyl-3H-1,3-benzoxazol-2-one Openeye Name: acetyl fluoride; 6-pyrrolidin-3-ylsulfonyl-3H-1,3-benzoxazol-2-one CAS Name: acetyl fluoride; 6-(3-pyrrolidinylsulfonyl)-3H-1,3-benzoxazol-2-one IUPAC Name: acetyl fluoride; 6-pyrrolidin-3-ylsulfonyl-3H-1,3-benzoxazol-2-one Traditional Name: acetyl fluoride; 6-pyrrolidin-3-ylsulfonyl-3H-1,3-benzoxazol-2-one Formula: C17H21F3N2O7S MolecularWeight: 454.41805

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)F.CC(=O)F.CC(=O)F.C1CNCC1S(=O)(=O)C2=CC3=C(C=C2)NC(=O)O3

Isomeric SMILES

CC(=O)F.CC(=O)F.CC(=O)F.C1CNCC1S(=O)(=O)C2=CC3=C(C=C2)NC(=O)O3

InChI

InChI=1S/C11H12N2O4S.3C2H3FO/c14-11-13-9-2-1-7(5-10(9)17-11)18(15,16)8-3-4-12-6-8;3*1-2(3)4/h1-2,5,8,12H,3-4,6H2,(H,13,14);3*1H3