N-[[5-(3,4-dimethoxyphenyl)isoquinolin-8-yl]methyl]-4-methoxy-benzenesulfonamide

Systemtic Name: N-[[5-(3,4-dimethoxyphenyl)isoquinolin-8-yl]methyl]-4-methoxy-benzenesulfonamide Openeye Name: N-[[5-(3,4-dimethoxyphenyl)-8-isoquinolyl]methyl]-4-methoxy-benzenesulfonamide CAS Name: N-[[5-(3,4-dimethoxyphenyl)-8-isoquinolinyl]methyl]-4-methoxybenzenesulfonamide IUPAC Name: N-[[5-(3,4-dimethoxyphenyl)isoquinolin-8-yl]methyl]-4-methoxybenzenesulfonamide Traditional Name: N-[[5-(3,4-dimethoxyphenyl)-8-isoquinolyl]methyl]-4-methoxy-benzenesulfonamide Formula: C25H24N2O5S MolecularWeight: 464.53346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NCC2=C3C=NC=CC3=C(C=C2)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NCC2=C3C=NC=CC3=C(C=C2)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C25H24N2O5S/c1-30-19-6-8-20(9-7-19)33(28,29)27-15-18-4-10-21(22-12-13-26-16-23(18)22)17-5-11-24(31-2)25(14-17)32-3/h4-14,16,27H,15H2,1-3H3