2-[(4-phenylphenyl)methyl]isoquinolin-2-ium chloride

Systemtic Name: 2-[(4-phenylphenyl)methyl]isoquinolin-2-ium chloride Openeye Name: 2-[(4-phenylphenyl)methyl]isoquinolin-2-ium chloride CAS Name: 2-[(4-phenylphenyl)methyl]isoquinolin-2-ium chloride IUPAC Name: 2-[(4-phenylphenyl)methyl]isoquinolin-2-ium chloride Traditional Name: 2-(4-phenylbenzyl)isoquinolin-2-ium chloride Formula: C22H18ClN MolecularWeight: 331.83802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C[N+]3=CC4=CC=CC=C4C=C3.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C[N+]3=CC4=CC=CC=C4C=C3.[Cl-]

InChI

InChI=1S/C22H18N.ClH/c1-2-6-19(7-3-1)21-12-10-18(11-13-21)16-23-15-14-20-8-4-5-9-22(20)17-23;/h1-15,17H,16H2;1H/q+1;/p-1