5-chloranyl-2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethoxy]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 5-chloranyl-2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethoxy]-N,N-diethyl-benzenesulfonamide Openeye Name: 5-chloro-2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethoxy]-N,N-diethyl-benzenesulfonamide CAS Name: 5-chloro-2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethoxy]-N,N-diethylbenzenesulfonamide IUPAC Name: 5-chloro-2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethoxy]-N,N-diethylbenzenesulfonamide Traditional Name: 5-chloro-2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethoxy]-N,N-diethyl-benzenesulfonamide Formula: C21H25ClN2O4S MolecularWeight: 436.9522

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)Cl)OCC(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)Cl)OCC(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C21H25ClN2O4S/c1-3-24(4-2)29(26,27)20-13-18(22)9-10-19(20)28-15-21(25)23-12-11-16-7-5-6-8-17(16)14-23/h5-10,13H,3-4,11-12,14-15H2,1-2H3