2-methylpropanoyl 3-azanyl-2-chloranyl-4-fluoranyl-5-(3-oxidanylidenepentanoyl)benzenecarboperoxoate

Systemtic Name: 2-methylpropanoyl 3-azanyl-2-chloranyl-4-fluoranyl-5-(3-oxidanylidenepentanoyl)benzenecarboperoxoate Openeye Name: 2-methylpropanoyl 3-amino-2-chloro-4-fluoro-5-(3-oxopentanoyl)benzenecarboperoxoate CAS Name: 3-amino-2-chloro-5-(1,3-dioxopentyl)-4-fluorobenzenecarboperoxoic acid (2-methyl-1-oxopropyl) ester IUPAC Name: 2-methylpropanoyl 3-amino-2-chloro-4-fluoro-5-(3-oxopentanoyl)benzenecarboperoxoate Traditional Name: 3-amino-2-chloro-4-fluoro-5-(3-ketopentanoyl)benzenecarboperoxoic acid isobutyryl ester Formula: C16H17ClFNO6 MolecularWeight: 373.760683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CC(=O)C1=CC(=C(C(=C1F)N)Cl)C(=O)OOC(=O)C(C)C

Isomeric SMILES

CCC(=O)CC(=O)C1=CC(=C(C(=C1F)N)Cl)C(=O)OOC(=O)C(C)C

InChI

InChI=1S/C16H17ClFNO6/c1-4-8(20)5-11(21)9-6-10(12(17)14(19)13(9)18)16(23)25-24-15(22)7(2)3/h6-7H,4-5,19H2,1-3H3