N-[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methyl]naphthalene-2-sulfonamide

Systemtic Name: N-[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methyl]naphthalene-2-sulfonamide Openeye Name: N-[(6,7-dimethoxy-1-isoquinolyl)-(3,4-dimethoxyphenyl)methyl]naphthalene-2-sulfonamide CAS Name: N-[(6,7-dimethoxy-1-isoquinolinyl)-(3,4-dimethoxyphenyl)methyl]-2-naphthalenesulfonamide IUPAC Name: N-[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methyl]naphthalene-2-sulfonamide Traditional Name: N-[(6,7-dimethoxy-1-isoquinolyl)-(3,4-dimethoxyphenyl)methyl]naphthalene-2-sulfonamide Formula: C30H28N2O6S MolecularWeight: 544.61812

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C2=NC=CC3=CC(=C(C=C32)OC)OC)NS(=O)(=O)C4=CC5=CC=CC=C5C=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C2=NC=CC3=CC(=C(C=C32)OC)OC)NS(=O)(=O)C4=CC5=CC=CC=C5C=C4)OC

InChI

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