N-[(3,5-dimethoxyphenyl)methyl]isoquinoline-5-sulfonamide

Systemtic Name: N-[(3,5-dimethoxyphenyl)methyl]isoquinoline-5-sulfonamide Openeye Name: N-[(3,5-dimethoxyphenyl)methyl]isoquinoline-5-sulfonamide CAS Name: N-[(3,5-dimethoxyphenyl)methyl]-5-isoquinolinesulfonamide IUPAC Name: N-[(3,5-dimethoxyphenyl)methyl]isoquinoline-5-sulfonamide Traditional Name: N-(3,5-dimethoxybenzyl)isoquinoline-5-sulfonamide Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CNS(=O)(=O)C2=CC=CC3=C2C=CN=C3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CNS(=O)(=O)C2=CC=CC3=C2C=CN=C3)OC

InChI

InChI=1S/C18H18N2O4S/c1-23-15-8-13(9-16(10-15)24-2)11-20-25(21,22)18-5-3-4-14-12-19-7-6-17(14)18/h3-10,12,20H,11H2,1-2H3