5-(4-methyl-1,4-dihydroquinolin-1-ium-1-yl)pentanoic acid bromide

Systemtic Name: 5-(4-methyl-1,4-dihydroquinolin-1-ium-1-yl)pentanoic acid bromide Openeye Name: 5-(4-methyl-1,4-dihydroquinolin-1-ium-1-yl)pentanoic acid bromide CAS Name: 5-(4-methyl-1,4-dihydroquinolin-1-ium-1-yl)pentanoic acid bromide IUPAC Name: 5-(4-methyl-1,4-dihydroquinolin-1-ium-1-yl)pentanoic acid bromide Traditional Name: 5-(4-methyl-1,4-dihydroquinolin-1-ium-1-yl)valeric acid bromide Formula: C15H20BrNO2 MolecularWeight: 326.2288

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=C[NH+](C2=CC=CC=C12)CCCCC(=O)O.[Br-]

Isomeric SMILES

CC1C=C[NH+](C2=CC=CC=C12)CCCCC(=O)O.[Br-]

InChI

InChI=1S/C15H19NO2.BrH/c1-12-9-11-16(10-5-4-8-15(17)18)14-7-3-2-6-13(12)14;/h2-3,6-7,9,11-12H,4-5,8,10H2,1H3,(H,17,18);1H