6-methoxy-1-[(4-methoxy-3-oxidanyl-phenyl)methyl]-2-methyl-isoquinolin-2-ium-7-ol perchlorate

Systemtic Name: 6-methoxy-1-[(4-methoxy-3-oxidanyl-phenyl)methyl]-2-methyl-isoquinolin-2-ium-7-ol perchlorate Openeye Name: 1-[(3-hydroxy-4-methoxy-phenyl)methyl]-6-methoxy-2-methyl-isoquinolin-2-ium-7-ol perchlorate CAS Name: 1-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2-methyl-7-isoquinolin-2-iumol perchlorate IUPAC Name: 1-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2-methylisoquinolin-2-ium-7-ol perchlorate Traditional Name: 1-(3-hydroxy-4-methoxy-benzyl)-6-methoxy-2-methyl-isoquinolin-2-ium-7-ol perchlorate Formula: C19H20ClNO8 MolecularWeight: 425.817

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C2=CC(=C(C=C2C=C1)OC)O)CC3=CC(=C(C=C3)OC)O.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C[N+]1=C(C2=CC(=C(C=C2C=C1)OC)O)CC3=CC(=C(C=C3)OC)O.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C19H19NO4.ClHO4/c1-20-7-6-13-10-19(24-3)17(22)11-14(13)15(20)8-12-4-5-18(23-2)16(21)9-12;2-1(3,4)5/h4-7,9-11H,8H2,1-3H3,(H-,21,22);(H,2,3,4,5)