1-methyl-2-(phenylmethyl)isoquinolin-2-ium-4-ol bromide

Systemtic Name: 1-methyl-2-(phenylmethyl)isoquinolin-2-ium-4-ol bromide Openeye Name: 2-benzyl-1-methyl-isoquinolin-2-ium-4-ol bromide CAS Name: 1-methyl-2-(phenylmethyl)-4-isoquinolin-2-iumol bromide IUPAC Name: 2-benzyl-1-methylisoquinolin-2-ium-4-ol bromide Traditional Name: 2-benzyl-1-methyl-isoquinolin-2-ium-4-ol bromide Formula: C17H16BrNO MolecularWeight: 330.21904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=C(C2=CC=CC=C12)O)CC3=CC=CC=C3.[Br-]

Isomeric SMILES

CC1=[N+](C=C(C2=CC=CC=C12)O)CC3=CC=CC=C3.[Br-]

InChI

InChI=1S/C17H15NO.BrH/c1-13-15-9-5-6-10-16(15)17(19)12-18(13)11-14-7-3-2-4-8-14;/h2-10,12H,11H2,1H3;1H