2-[(3,4-dichlorophenyl)methyl]isoquinolin-2-ium chloride

Systemtic Name: 2-[(3,4-dichlorophenyl)methyl]isoquinolin-2-ium chloride Openeye Name: 2-[(3,4-dichlorophenyl)methyl]isoquinolin-2-ium chloride CAS Name: 2-[(3,4-dichlorophenyl)methyl]isoquinolin-2-ium chloride IUPAC Name: 2-[(3,4-dichlorophenyl)methyl]isoquinolin-2-ium chloride Traditional Name: 2-(3,4-dichlorobenzyl)isoquinolin-2-ium chloride Formula: C16H12Cl3N MolecularWeight: 324.63218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=[N+](C=CC2=C1)CC3=CC(=C(C=C3)Cl)Cl.[Cl-]

Isomeric SMILES

C1=CC=C2C=[N+](C=CC2=C1)CC3=CC(=C(C=C3)Cl)Cl.[Cl-]

InChI

InChI=1S/C16H12Cl2N.ClH/c17-15-6-5-12(9-16(15)18)10-19-8-7-13-3-1-2-4-14(13)11-19;/h1-9,11H,10H2;1H/q+1;/p-1