methyl 4-(2-azanylpiperidin-1-yl)-3-fluoranyl-benzoate

Systemtic Name: methyl 4-(2-azanylpiperidin-1-yl)-3-fluoranyl-benzoate Openeye Name: methyl 4-(2-amino-1-piperidyl)-3-fluoro-benzoate CAS Name: 4-(2-amino-1-piperidinyl)-3-fluorobenzoic acid methyl ester IUPAC Name: methyl 4-(2-aminopiperidin-1-yl)-3-fluorobenzoate Traditional Name: 4-(2-aminopiperidino)-3-fluoro-benzoic acid methyl ester Formula: C13H17FN2O2 MolecularWeight: 252.284683

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)N2CCCCC2N)F

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)N2CCCCC2N)F

InChI

InChI=1S/C13H17FN2O2/c1-18-13(17)9-5-6-11(10(14)8-9)16-7-3-2-4-12(16)15/h5-6,8,12H,2-4,7,15H2,1H3