3-chloranyl-N-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-N-propyl-benzenesulfonamide

Systemtic Name: 3-chloranyl-N-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-N-propyl-benzenesulfonamide Openeye Name: 3-chloro-N-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-N-propyl-benzenesulfonamide CAS Name: 3-chloro-N-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N-propylbenzenesulfonamide IUPAC Name: 3-chloro-N-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N-propylbenzenesulfonamide Traditional Name: 3-chloro-N-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]-N-propyl-benzenesulfonamide Formula: C22H27ClN2O5S MolecularWeight: 466.97818

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)N1CCC2=CC(=C(C=C2C1)OC)OC)S(=O)(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCCN(CC(=O)N1CCC2=CC(=C(C=C2C1)OC)OC)S(=O)(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H27ClN2O5S/c1-4-9-25(31(27,28)19-7-5-6-18(23)13-19)15-22(26)24-10-8-16-11-20(29-2)21(30-3)12-17(16)14-24/h5-7,11-13H,4,8-10,14-15H2,1-3H3