N-[6,7-dimethoxy-1-(3-propan-2-yloxyphenyl)carbonyl-isoquinolin-4-yl]ethanesulfonamide

Systemtic Name: N-[6,7-dimethoxy-1-(3-propan-2-yloxyphenyl)carbonyl-isoquinolin-4-yl]ethanesulfonamide Openeye Name: N-[1-(3-isopropoxybenzoyl)-6,7-dimethoxy-4-isoquinolyl]ethanesulfonamide CAS Name: N-[6,7-dimethoxy-1-[oxo-(3-propan-2-yloxyphenyl)methyl]-4-isoquinolinyl]ethanesulfonamide IUPAC Name: N-[6,7-dimethoxy-1-(3-propan-2-yloxybenzoyl)isoquinolin-4-yl]ethanesulfonamide Traditional Name: N-[1-(3-isopropoxybenzoyl)-6,7-dimethoxy-4-isoquinolyl]ethanesulfonamide Formula: C23H26N2O6S MolecularWeight: 458.52734

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC1=CN=C(C2=CC(=C(C=C21)OC)OC)C(=O)C3=CC(=CC=C3)OC(C)C

Isomeric SMILES

CCS(=O)(=O)NC1=CN=C(C2=CC(=C(C=C21)OC)OC)C(=O)C3=CC(=CC=C3)OC(C)C

InChI

InChI=1S/C23H26N2O6S/c1-6-32(27,28)25-19-13-24-22(18-12-21(30-5)20(29-4)11-17(18)19)23(26)15-8-7-9-16(10-15)31-14(2)3/h7-14,25H,6H2,1-5H3