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

Systemtic Name: methyl 4-(4-azidopiperidin-1-yl)-2,3-bis(fluoranyl)benzoate Openeye Name: methyl 4-(4-azido-1-piperidyl)-2,3-difluoro-benzoate CAS Name: 4-(4-azido-1-piperidinyl)-2,3-difluorobenzoic acid methyl ester IUPAC Name: methyl 4-(4-azidopiperidin-1-yl)-2,3-difluorobenzoate Traditional Name: 4-(4-azidopiperidino)-2,3-difluoro-benzoic acid methyl ester Formula: C13H14F2N4O2 MolecularWeight: 296.272666

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=C(C=C1)N2CCC(CC2)N=[N+]=[N-])F)F

Isomeric SMILES

COC(=O)C1=C(C(=C(C=C1)N2CCC(CC2)N=[N+]=[N-])F)F

InChI

InChI=1S/C13H14F2N4O2/c1-21-13(20)9-2-3-10(12(15)11(9)14)19-6-4-8(5-7-19)17-18-16/h2-3,8H,4-7H2,1H3