4-chloranyl-3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-N,N-diethyl-benzenesulfonamide

Systemtic Name: 4-chloranyl-3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-N,N-diethyl-benzenesulfonamide Openeye Name: 4-chloro-3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N,N-diethyl-benzenesulfonamide CAS Name: 4-chloro-3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 4-chloro-3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N,N-diethylbenzenesulfonamide Traditional Name: 4-chloro-3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N,N-diethyl-benzenesulfonamide Formula: C20H23ClN2O3S MolecularWeight: 406.92622

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23ClN2O3S/c1-3-23(4-2)27(25,26)17-9-10-19(21)18(13-17)20(24)22-12-11-15-7-5-6-8-16(15)14-22/h5-10,13H,3-4,11-12,14H2,1-2H3