methyl 2-[4-[1-(2-methoxy-2-oxidanylidene-ethyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]ethanoate

Systemtic Name: methyl 2-[4-[1-(2-methoxy-2-oxidanylidene-ethyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]ethanoate Openeye Name: methyl 2-[4-[1-(2-methoxy-2-oxo-ethyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]acetate CAS Name: 2-[4-[1-(2-methoxy-2-oxoethyl)-4-pyridin-1-iumyl]-1-pyridin-1-iumyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[1-(2-methoxy-2-oxoethyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]acetate Traditional Name: 2-[4-[1-(2-keto-2-methoxy-ethyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]acetic acid methyl ester Formula: C16H18N2O4+2 MolecularWeight: 302.32512

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)CC(=O)OC

Isomeric SMILES

COC(=O)C[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)CC(=O)OC

InChI

InChI=1S/C16H18N2O4/c1-21-15(19)11-17-7-3-13(4-8-17)14-5-9-18(10-6-14)12-16(20)22-2/h3-10H,11-12H2,1-2H3/q+2