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

Systemtic Name: 1-chloranyl-N-[[6,7-dimethoxy-1-(3-propan-2-yloxyphenyl)carbonyl-isoquinolin-4-yl]methyl]methanesulfonamide Openeye Name: 1-chloro-N-[[1-(3-isopropoxybenzoyl)-6,7-dimethoxy-4-isoquinolyl]methyl]methanesulfonamide CAS Name: 1-chloro-N-[[6,7-dimethoxy-1-[oxo-(3-propan-2-yloxyphenyl)methyl]-4-isoquinolinyl]methyl]methanesulfonamide IUPAC Name: 1-chloro-N-[[6,7-dimethoxy-1-(3-propan-2-yloxybenzoyl)isoquinolin-4-yl]methyl]methanesulfonamide Traditional Name: 1-chloro-N-[[1-(3-isopropoxybenzoyl)-6,7-dimethoxy-4-isoquinolyl]methyl]methanesulfonamide Formula: C23H25ClN2O6S MolecularWeight: 492.9724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C(=O)C2=NC=C(C3=CC(=C(C=C32)OC)OC)CNS(=O)(=O)CCl

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C(=O)C2=NC=C(C3=CC(=C(C=C32)OC)OC)CNS(=O)(=O)CCl

InChI

InChI=1S/C23H25ClN2O6S/c1-14(2)32-17-7-5-6-15(8-17)23(27)22-19-10-21(31-4)20(30-3)9-18(19)16(11-25-22)12-26-33(28,29)13-24/h5-11,14,26H,12-13H2,1-4H3