methyl 5-(4-azanylbutanoylamino)-2,4-bis(fluoranyl)benzoate

Systemtic Name: methyl 5-(4-azanylbutanoylamino)-2,4-bis(fluoranyl)benzoate Openeye Name: methyl 5-(4-aminobutanoylamino)-2,4-difluoro-benzoate CAS Name: 5-[(4-amino-1-oxobutyl)amino]-2,4-difluorobenzoic acid methyl ester IUPAC Name: methyl 5-(4-aminobutanoylamino)-2,4-difluorobenzoate Traditional Name: 5-(4-aminobutanoylamino)-2,4-difluoro-benzoic acid methyl ester Formula: C12H14F2N2O3 MolecularWeight: 272.247966

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1F)F)NC(=O)CCCN

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1F)F)NC(=O)CCCN

InChI

InChI=1S/C12H14F2N2O3/c1-19-12(18)7-5-10(9(14)6-8(7)13)16-11(17)3-2-4-15/h5-6H,2-4,15H2,1H3,(H,16,17)