2-(phenylmethyl)isoquinolin-2-ium-5-amine bromide

Systemtic Name: 2-(phenylmethyl)isoquinolin-2-ium-5-amine bromide Openeye Name: 2-benzylisoquinolin-2-ium-5-amine bromide CAS Name: 2-(phenylmethyl)-5-isoquinolin-2-iumamine bromide IUPAC Name: 2-benzylisoquinolin-2-ium-5-amine bromide Traditional Name: (2-benzylisoquinolin-2-ium-5-yl)amine bromide Formula: C16H15BrN2 MolecularWeight: 315.2077

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=CC3=C(C=C2)C(=CC=C3)N.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=CC3=C(C=C2)C(=CC=C3)N.[Br-]

InChI

InChI=1S/C16H15N2.BrH/c17-16-8-4-7-14-12-18(10-9-15(14)16)11-13-5-2-1-3-6-13;/h1-10,12H,11,17H2;1H/q+1;/p-1