ethyl 11-(3-aminocarbonylpyridin-1-ium-1-yl)undecanoate bromide

Systemtic Name: ethyl 11-(3-aminocarbonylpyridin-1-ium-1-yl)undecanoate bromide Openeye Name: ethyl 11-(3-carbamoylpyridin-1-ium-1-yl)undecanoate bromide CAS Name: 11-(3-carbamoyl-1-pyridin-1-iumyl)undecanoic acid ethyl ester bromide IUPAC Name: ethyl 11-(3-carbamoylpyridin-1-ium-1-yl)undecanoate bromide Traditional Name: 11-(3-carbamoylpyridin-1-ium-1-yl)undecanoic acid ethyl ester bromide Formula: C19H31BrN2O3 MolecularWeight: 415.36504

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCCCCC[N+]1=CC=CC(=C1)C(=O)N.[Br-]

Isomeric SMILES

CCOC(=O)CCCCCCCCCC[N+]1=CC=CC(=C1)C(=O)N.[Br-]

InChI

InChI=1S/C19H30N2O3.BrH/c1-2-24-18(22)13-9-7-5-3-4-6-8-10-14-21-15-11-12-17(16-21)19(20)23;/h11-12,15-16H,2-10,13-14H2,1H3,(H-,20,23);1H