6,7-dimethoxy-2-methyl-4-phenyl-isoquinolin-2-ium perchlorate

Systemtic Name: 6,7-dimethoxy-2-methyl-4-phenyl-isoquinolin-2-ium perchlorate Openeye Name: 6,7-dimethoxy-2-methyl-4-phenyl-isoquinolin-2-ium perchlorate CAS Name: 6,7-dimethoxy-2-methyl-4-phenylisoquinolin-2-ium perchlorate IUPAC Name: 6,7-dimethoxy-2-methyl-4-phenylisoquinolin-2-ium perchlorate Traditional Name: 6,7-dimethoxy-2-methyl-4-phenyl-isoquinolin-2-ium perchlorate Formula: C18H18ClNO6 MolecularWeight: 379.79162

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC2=CC(=C(C=C2C(=C1)C3=CC=CC=C3)OC)OC.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C[N+]1=CC2=CC(=C(C=C2C(=C1)C3=CC=CC=C3)OC)OC.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C18H18NO2.ClHO4/c1-19-11-14-9-17(20-2)18(21-3)10-15(14)16(12-19)13-7-5-4-6-8-13;2-1(3,4)5/h4-12H,1-3H3;(H,2,3,4,5)/q+1;/p-1