methyl 5-(1-methoxypyridin-1-ium-3-yl)pentanoate

Systemtic Name: methyl 5-(1-methoxypyridin-1-ium-3-yl)pentanoate Openeye Name: methyl 5-(1-methoxypyridin-1-ium-3-yl)pentanoate CAS Name: 5-(1-methoxy-3-pyridin-1-iumyl)pentanoic acid methyl ester IUPAC Name: methyl 5-(1-methoxypyridin-1-ium-3-yl)pentanoate Traditional Name: 5-(1-methoxypyridin-1-ium-3-yl)valeric acid methyl ester Formula: C12H18NO3+ MolecularWeight: 224.27622

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCC1=C[N+](=CC=C1)OC

Isomeric SMILES

COC(=O)CCCCC1=C[N+](=CC=C1)OC

InChI

InChI=1S/C12H18NO3/c1-15-12(14)8-4-3-6-11-7-5-9-13(10-11)16-2/h5,7,9-10H,3-4,6,8H2,1-2H3/q+1