methyl 5-[[2-(4-aminocarbonylpiperidin-1-yl)-2-oxidanylidene-ethyl]amino]-2-fluoranyl-benzoate

Systemtic Name: methyl 5-[[2-(4-aminocarbonylpiperidin-1-yl)-2-oxidanylidene-ethyl]amino]-2-fluoranyl-benzoate Openeye Name: methyl 5-[[2-(4-carbamoyl-1-piperidyl)-2-oxo-ethyl]amino]-2-fluoro-benzoate CAS Name: 5-[[2-(4-carbamoyl-1-piperidinyl)-2-oxoethyl]amino]-2-fluorobenzoic acid methyl ester IUPAC Name: methyl 5-[[2-(4-carbamoylpiperidin-1-yl)-2-oxoethyl]amino]-2-fluorobenzoate Traditional Name: 5-[[2-(4-carbamoylpiperidino)-2-keto-ethyl]amino]-2-fluoro-benzoic acid methyl ester Formula: C16H20FN3O4 MolecularWeight: 337.346103

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)NCC(=O)N2CCC(CC2)C(=O)N)F

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)NCC(=O)N2CCC(CC2)C(=O)N)F

InChI

InChI=1S/C16H20FN3O4/c1-24-16(23)12-8-11(2-3-13(12)17)19-9-14(21)20-6-4-10(5-7-20)15(18)22/h2-3,8,10,19H,4-7,9H2,1H3,(H2,18,22)