methyl 5-(6-azanylhexanoylamino)-2-fluoranyl-benzoate

Systemtic Name: methyl 5-(6-azanylhexanoylamino)-2-fluoranyl-benzoate Openeye Name: methyl 5-(6-aminohexanoylamino)-2-fluoro-benzoate CAS Name: 5-[(6-amino-1-oxohexyl)amino]-2-fluorobenzoic acid methyl ester IUPAC Name: methyl 5-(6-aminohexanoylamino)-2-fluorobenzoate Traditional Name: 5-(6-aminohexanoylamino)-2-fluoro-benzoic acid methyl ester Formula: C14H19FN2O3 MolecularWeight: 282.310663

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19FN2O3/c1-20-14(19)11-9-10(6-7-12(11)15)17-13(18)5-3-2-4-8-16/h6-7,9H,2-5,8,16H2,1H3,(H,17,18)