15-(6-methoxyquinolin-1-ium-1-yl)pentadecanoic acid bromide

Systemtic Name: 15-(6-methoxyquinolin-1-ium-1-yl)pentadecanoic acid bromide Openeye Name: 15-(6-methoxyquinolin-1-ium-1-yl)pentadecanoic acid bromide CAS Name: 15-(6-methoxy-1-quinolin-1-iumyl)pentadecanoic acid bromide IUPAC Name: 15-(6-methoxyquinolin-1-ium-1-yl)pentadecanoic acid bromide Traditional Name: 15-(6-methoxyquinolin-1-ium-1-yl)pentadecanoic acid bromide Formula: C25H38BrNO3 MolecularWeight: 480.47812

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)[N+](=CC=C2)CCCCCCCCCCCCCCC(=O)O.[Br-]

Isomeric SMILES

COC1=CC2=C(C=C1)[N+](=CC=C2)CCCCCCCCCCCCCCC(=O)O.[Br-]

InChI

InChI=1S/C25H37NO3.BrH/c1-29-23-17-18-24-22(21-23)15-14-20-26(24)19-13-11-9-7-5-3-2-4-6-8-10-12-16-25(27)28;/h14-15,17-18,20-21H,2-13,16,19H2,1H3;1H