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

Systemtic Name: N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxy-phenyl]naphthalene-2-sulfonamide Openeye Name: N-[2-[(6,7-dimethoxy-1-isoquinolyl)methyl]-4,5-dimethoxy-phenyl]naphthalene-2-sulfonamide CAS Name: N-[2-[(6,7-dimethoxy-1-isoquinolinyl)methyl]-4,5-dimethoxyphenyl]-2-naphthalenesulfonamide IUPAC Name: N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl]naphthalene-2-sulfonamide Traditional Name: N-[2-[(6,7-dimethoxy-1-isoquinolyl)methyl]-4,5-dimethoxy-phenyl]naphthalene-2-sulfonamide Formula: C30H28N2O6S MolecularWeight: 544.61812

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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=CC5=CC=CC=C5C=C4)OC)OC)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=CN=C2CC3=CC(=C(C=C3NS(=O)(=O)C4=CC5=CC=CC=C5C=C4)OC)OC)OC

InChI

InChI=1S/C30H28N2O6S/c1-35-27-15-21-11-12-31-26(24(21)17-29(27)37-3)14-22-16-28(36-2)30(38-4)18-25(22)32-39(33,34)23-10-9-19-7-5-6-8-20(19)13-23/h5-13,15-18,32H,14H2,1-4H3