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

Systemtic Name: methyl 2-[4-[(2-azanyl-2-oxidanylidene-ethyl)amino]piperidin-1-yl]-5-fluoranyl-benzoate Openeye Name: methyl 2-[4-[(2-amino-2-oxo-ethyl)amino]-1-piperidyl]-5-fluoro-benzoate CAS Name: 2-[4-[(2-amino-2-oxoethyl)amino]-1-piperidinyl]-5-fluorobenzoic acid methyl ester IUPAC Name: methyl 2-[4-[(2-amino-2-oxoethyl)amino]piperidin-1-yl]-5-fluorobenzoate Traditional Name: 2-[4-[(2-amino-2-keto-ethyl)amino]piperidino]-5-fluoro-benzoic acid methyl ester Formula: C15H20FN3O3 MolecularWeight: 309.336003

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20FN3O3/c1-22-15(21)12-8-10(16)2-3-13(12)19-6-4-11(5-7-19)18-9-14(17)20/h2-3,8,11,18H,4-7,9H2,1H3,(H2,17,20)