methyl 5-(3-azanylpropanoylamino)-2-fluoranyl-benzoate

Systemtic Name: methyl 5-(3-azanylpropanoylamino)-2-fluoranyl-benzoate Openeye Name: methyl 5-(3-aminopropanoylamino)-2-fluoro-benzoate CAS Name: 5-[(3-amino-1-oxopropyl)amino]-2-fluorobenzoic acid methyl ester IUPAC Name: methyl 5-(3-aminopropanoylamino)-2-fluorobenzoate Traditional Name: 5-(3-aminopropanoylamino)-2-fluoro-benzoic acid methyl ester Formula: C11H13FN2O3 MolecularWeight: 240.230923

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)NC(=O)CCN)F

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)NC(=O)CCN)F

InChI

InChI=1S/C11H13FN2O3/c1-17-11(16)8-6-7(2-3-9(8)12)14-10(15)4-5-13/h2-3,6H,4-5,13H2,1H3,(H,14,15)