5-[1,4-dimethoxy-1,4-bis(oxidanylidene)-3-pyridin-1-ium-1-yl-butan-2-yl]-2,2-dimethyl-6-oxidanylidene-1,3-dioxin-4-olate

Systemtic Name: 5-[1,4-dimethoxy-1,4-bis(oxidanylidene)-3-pyridin-1-ium-1-yl-butan-2-yl]-2,2-dimethyl-6-oxidanylidene-1,3-dioxin-4-olate Openeye Name: 5-(3-methoxy-1-methoxycarbonyl-3-oxo-2-pyridin-1-ium-1-yl-propyl)-2,2-dimethyl-6-oxo-1,3-dioxin-4-olate CAS Name: 5-[1,4-dimethoxy-1,4-dioxo-3-(1-pyridin-1-iumyl)butan-2-yl]-2,2-dimethyl-6-oxo-1,3-dioxin-4-olate IUPAC Name: 5-(1,4-dimethoxy-1,4-dioxo-3-pyridin-1-ium-1-ylbutan-2-yl)-2,2-dimethyl-6-oxo-1,3-dioxin-4-olate Traditional Name: 5-(1-carbomethoxy-3-keto-3-methoxy-2-pyridin-1-ium-1-yl-propyl)-6-keto-2,2-dimethyl-1,3-dioxin-4-olate Formula: C17H19NO8 MolecularWeight: 365.33466

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=C(C(=O)O1)C(C(C(=O)OC)[N+]2=CC=CC=C2)C(=O)OC)[O-])C

Isomeric SMILES

CC1(OC(=C(C(=O)O1)C(C(C(=O)OC)[N+]2=CC=CC=C2)C(=O)OC)[O-])C

InChI

InChI=1S/C17H19NO8/c1-17(2)25-14(20)11(15(21)26-17)10(13(19)23-3)12(16(22)24-4)18-8-6-5-7-9-18/h5-10,12H,1-4H3