methyl 2-[1-azanyl-2,3-bis(fluoranyl)pyridin-1-ium-4-yl]ethanoate hydrochloride

Systemtic Name: methyl 2-[1-azanyl-2,3-bis(fluoranyl)pyridin-1-ium-4-yl]ethanoate hydrochloride Openeye Name: methyl 2-(1-amino-2,3-difluoro-pyridin-1-ium-4-yl)acetate hydrochloride CAS Name: 2-(1-amino-2,3-difluoro-4-pyridin-1-iumyl)acetic acid methyl ester hydrochloride IUPAC Name: methyl 2-(1-amino-2,3-difluoropyridin-1-ium-4-yl)acetate hydrochloride Traditional Name: 2-(1-amino-2,3-difluoro-pyridin-1-ium-4-yl)acetic acid methyl ester hydrochloride Formula: C8H10ClF2N2O2+ MolecularWeight: 239.627006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=C(C(=[N+](C=C1)N)F)F.Cl

Isomeric SMILES

COC(=O)CC1=C(C(=[N+](C=C1)N)F)F.Cl

InChI

InChI=1S/C8H9F2N2O2.ClH/c1-14-6(13)4-5-2-3-12(11)8(10)7(5)9;/h2-3H,4,11H2,1H3;1H/q+1;