1-naphthalen-1-yl-2-(phenylmethyl)isoquinolin-2-ium perchlorate

Systemtic Name: 1-naphthalen-1-yl-2-(phenylmethyl)isoquinolin-2-ium perchlorate Openeye Name: 2-benzyl-1-(1-naphthyl)isoquinolin-2-ium perchlorate CAS Name: 1-(1-naphthalenyl)-2-(phenylmethyl)isoquinolin-2-ium perchlorate IUPAC Name: 2-benzyl-1-naphthalen-1-ylisoquinolin-2-ium perchlorate Traditional Name: 2-benzyl-1-(1-naphthyl)isoquinolin-2-ium perchlorate Formula: C26H20ClNO4 MolecularWeight: 445.8943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=C(C3=CC=CC=C3C=C2)C4=CC=CC5=CC=CC=C54.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=C(C3=CC=CC=C3C=C2)C4=CC=CC5=CC=CC=C54.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C26H20N.ClHO4/c1-2-9-20(10-3-1)19-27-18-17-22-12-5-7-15-24(22)26(27)25-16-8-13-21-11-4-6-14-23(21)25;2-1(3,4)5/h1-18H,19H2;(H,2,3,4,5)/q+1;/p-1