methyl 10-[methyl-(3-methylimidazol-3-ium-1-yl)amino]-10-oxidanylidene-decanoate

Systemtic Name: methyl 10-[methyl-(3-methylimidazol-3-ium-1-yl)amino]-10-oxidanylidene-decanoate Openeye Name: methyl 10-[methyl-(3-methylimidazol-3-ium-1-yl)amino]-10-oxo-decanoate CAS Name: 10-[methyl-(3-methyl-1-imidazol-3-iumyl)amino]-10-oxodecanoic acid methyl ester IUPAC Name: methyl 10-[methyl-(3-methylimidazol-3-ium-1-yl)amino]-10-oxodecanoate Traditional Name: 10-keto-10-[methyl-(3-methylimidazol-3-ium-1-yl)amino]capric acid methyl ester Formula: C16H28N3O3+ MolecularWeight: 310.41182

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C=C1)N(C)C(=O)CCCCCCCCC(=O)OC

Isomeric SMILES

C[N+]1=CN(C=C1)N(C)C(=O)CCCCCCCCC(=O)OC

InChI

InChI=1S/C16H28N3O3/c1-17-12-13-19(14-17)18(2)15(20)10-8-6-4-5-7-9-11-16(21)22-3/h12-14H,4-11H2,1-3H3/q+1