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

Systemtic Name: 2-ethyl-6,7-dimethoxy-4-phenyl-isoquinolin-2-ium perchlorate Openeye Name: 2-ethyl-6,7-dimethoxy-4-phenyl-isoquinolin-2-ium perchlorate CAS Name: 2-ethyl-6,7-dimethoxy-4-phenylisoquinolin-2-ium perchlorate IUPAC Name: 2-ethyl-6,7-dimethoxy-4-phenylisoquinolin-2-ium perchlorate Traditional Name: 2-ethyl-6,7-dimethoxy-4-phenyl-isoquinolin-2-ium perchlorate Formula: C19H20ClNO6 MolecularWeight: 393.8182

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20NO2.ClHO4/c1-4-20-12-15-10-18(21-2)19(22-3)11-16(15)17(13-20)14-8-6-5-7-9-14;2-1(3,4)5/h5-13H,4H2,1-3H3;(H,2,3,4,5)/q+1;/p-1