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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)N1CCC2=CC=CC=C2C1)S(=O)(=O)C3=CC(=C(C=C3)OCC)Cl

Isomeric SMILES

CCN(CC(=O)N1CCC2=CC=CC=C2C1)S(=O)(=O)C3=CC(=C(C=C3)OCC)Cl

InChI

InChI=1S/C21H25ClN2O4S/c1-3-24(29(26,27)18-9-10-20(28-4-2)19(22)13-18)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