N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxy-phenyl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxy-phenyl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[2-[(6,7-dimethoxy-1-isoquinolyl)methyl]-4,5-dimethoxy-phenyl]-4-fluoro-benzenesulfonamide CAS Name: N-[2-[(6,7-dimethoxy-1-isoquinolinyl)methyl]-4,5-dimethoxyphenyl]-4-fluorobenzenesulfonamide IUPAC Name: N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl]-4-fluorobenzenesulfonamide Traditional Name: N-[2-[(6,7-dimethoxy-1-isoquinolyl)methyl]-4,5-dimethoxy-phenyl]-4-fluoro-benzenesulfonamide Formula: C26H25FN2O6S MolecularWeight: 512.549903

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=CN=C2CC3=CC(=C(C=C3NS(=O)(=O)C4=CC=C(C=C4)F)OC)OC)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=CN=C2CC3=CC(=C(C=C3NS(=O)(=O)C4=CC=C(C=C4)F)OC)OC)OC

InChI

InChI=1S/C26H25FN2O6S/c1-32-23-12-16-9-10-28-22(20(16)14-25(23)34-3)11-17-13-24(33-2)26(35-4)15-21(17)29-36(30,31)19-7-5-18(27)6-8-19/h5-10,12-15,29H,11H2,1-4H3