methyl 2,4-bis(fluoranyl)-5-(3-methylbut-2-enoylamino)benzoate

Systemtic Name: methyl 2,4-bis(fluoranyl)-5-(3-methylbut-2-enoylamino)benzoate Openeye Name: methyl 2,4-difluoro-5-(3-methylbut-2-enoylamino)benzoate CAS Name: 2,4-difluoro-5-[(3-methyl-1-oxobut-2-enyl)amino]benzoic acid methyl ester IUPAC Name: methyl 2,4-difluoro-5-(3-methylbut-2-enoylamino)benzoate Traditional Name: 2,4-difluoro-5-(3-methylbut-2-enoylamino)benzoic acid methyl ester Formula: C13H13F2NO3 MolecularWeight: 269.244026

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=C(C=C(C(=C1)C(=O)OC)F)F)C

Isomeric SMILES

CC(=CC(=O)NC1=C(C=C(C(=C1)C(=O)OC)F)F)C

InChI

InChI=1S/C13H13F2NO3/c1-7(2)4-12(17)16-11-5-8(13(18)19-3)9(14)6-10(11)15/h4-6H,1-3H3,(H,16,17)