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

Systemtic Name: methyl 4-(4-azanylpiperidin-1-yl)-2,3-bis(fluoranyl)benzoate Openeye Name: methyl 4-(4-amino-1-piperidyl)-2,3-difluoro-benzoate CAS Name: 4-(4-amino-1-piperidinyl)-2,3-difluorobenzoic acid methyl ester IUPAC Name: methyl 4-(4-aminopiperidin-1-yl)-2,3-difluorobenzoate Traditional Name: 4-(4-aminopiperidino)-2,3-difluoro-benzoic acid methyl ester Formula: C13H16F2N2O2 MolecularWeight: 270.275146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16F2N2O2/c1-19-13(18)9-2-3-10(12(15)11(9)14)17-6-4-8(16)5-7-17/h2-3,8H,4-7,16H2,1H3