[2-[(6,7-dimethoxyisoquinolin-2-ium-1-yl)methyl]-4,5-dimethoxy-phenyl]-(4-methoxyphenyl)sulfonyl-azanide

Systemtic Name: [2-[(6,7-dimethoxyisoquinolin-2-ium-1-yl)methyl]-4,5-dimethoxy-phenyl]-(4-methoxyphenyl)sulfonyl-azanide Openeye Name: [2-[(6,7-dimethoxyisoquinolin-2-ium-1-yl)methyl]-4,5-dimethoxy-phenyl]-(4-methoxyphenyl)sulfonyl-azanide CAS Name: [2-[(6,7-dimethoxy-1-isoquinolin-2-iumyl)methyl]-4,5-dimethoxyphenyl]-(4-methoxyphenyl)sulfonylazanide IUPAC Name: [2-[(6,7-dimethoxyisoquinolin-2-ium-1-yl)methyl]-4,5-dimethoxyphenyl]-(4-methoxyphenyl)sulfonylazanide Traditional Name: [2-[(6,7-dimethoxyisoquinolin-2-ium-1-yl)methyl]-4,5-dimethoxy-phenyl]-(4-methoxyphenyl)sulfonyl-azanide Formula: C27H28N2O7S MolecularWeight: 524.58542

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)[N-]C2=CC(=C(C=C2CC3=[NH+]C=CC4=CC(=C(C=C43)OC)OC)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)[N-]C2=CC(=C(C=C2CC3=[NH+]C=CC4=CC(=C(C=C43)OC)OC)OC)OC

InChI

InChI=1S/C27H27N2O7S/c1-32-19-6-8-20(9-7-19)37(30,31)29-22-16-27(36-5)25(34-3)14-18(22)12-23-21-15-26(35-4)24(33-2)13-17(21)10-11-28-23/h6-11,13-16H,12H2,1-5H3/q-1/p+1