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

Systemtic Name: 3-chloranyl-4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethoxy]-N-(1-phenylethyl)benzenesulfonamide Openeye Name: 3-chloro-4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethoxy]-N-(1-phenylethyl)benzenesulfonamide CAS Name: 3-chloro-4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethoxy]-N-(1-phenylethyl)benzenesulfonamide IUPAC Name: 3-chloro-4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethoxy]-N-(1-phenylethyl)benzenesulfonamide Traditional Name: 3-chloro-4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethoxy]-N-(1-phenylethyl)benzenesulfonamide Formula: C25H25ClN2O4S MolecularWeight: 484.995

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)OCC(=O)N3CCC4=CC=CC=C4C3)Cl

Isomeric SMILES

CC(C1=CC=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)OCC(=O)N3CCC4=CC=CC=C4C3)Cl

InChI

InChI=1S/C25H25ClN2O4S/c1-18(19-7-3-2-4-8-19)27-33(30,31)22-11-12-24(23(26)15-22)32-17-25(29)28-14-13-20-9-5-6-10-21(20)16-28/h2-12,15,18,27H,13-14,16-17H2,1H3