1-bromanyl-4-(phenylmethyl)isoquinolin-2-ium-3-amine

Systemtic Name: 1-bromanyl-4-(phenylmethyl)isoquinolin-2-ium-3-amine Openeye Name: 4-benzyl-1-bromo-isoquinolin-2-ium-3-amine CAS Name: 1-bromo-4-(phenylmethyl)-3-isoquinolin-2-iumamine IUPAC Name: 4-benzyl-1-bromoisoquinolin-2-ium-3-amine Traditional Name: (4-benzyl-1-bromo-isoquinolin-2-ium-3-yl)amine Formula: C16H14BrN2+ MolecularWeight: 314.19976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C([NH+]=C(C3=CC=CC=C32)Br)N

Isomeric SMILES

C1=CC=C(C=C1)CC2=C([NH+]=C(C3=CC=CC=C32)Br)N

InChI

InChI=1S/C16H13BrN2/c17-15-13-9-5-4-8-12(13)14(16(18)19-15)10-11-6-2-1-3-7-11/h1-9H,10H2,(H2,18,19)/p+1