methyl 5-(7-azanylheptanoylamino)-2-fluoranyl-benzoate

Systemtic Name: methyl 5-(7-azanylheptanoylamino)-2-fluoranyl-benzoate Openeye Name: methyl 5-(7-aminoheptanoylamino)-2-fluoro-benzoate CAS Name: 5-[(7-amino-1-oxoheptyl)amino]-2-fluorobenzoic acid methyl ester IUPAC Name: methyl 5-(7-aminoheptanoylamino)-2-fluorobenzoate Traditional Name: 5-(7-aminoheptanoylamino)-2-fluoro-benzoic acid methyl ester Formula: C15H21FN2O3 MolecularWeight: 296.337243

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21FN2O3/c1-21-15(20)12-10-11(7-8-13(12)16)18-14(19)6-4-2-3-5-9-17/h7-8,10H,2-6,9,17H2,1H3,(H,18,19)