N-[3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]propyl]-2,4-dimethoxy-benzenesulfonamide

Systemtic Name: N-[3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]propyl]-2,4-dimethoxy-benzenesulfonamide Openeye Name: N-[3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]propyl]-2,4-dimethoxy-benzenesulfonamide CAS Name: N-[3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]propyl]-2,4-dimethoxybenzenesulfonamide IUPAC Name: N-[3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]propyl]-2,4-dimethoxybenzenesulfonamide Traditional Name: N-[3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]propyl]-2,4-dimethoxy-benzenesulfonamide Formula: C26H30N2O4S MolecularWeight: 466.5924

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)S(=O)(=O)NCCCC2=CC=C(C=C2)N3CCC4=CC=CC=C4C3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)S(=O)(=O)NCCCC2=CC=C(C=C2)N3CCC4=CC=CC=C4C3)OC

InChI

InChI=1S/C26H30N2O4S/c1-31-24-13-14-26(25(18-24)32-2)33(29,30)27-16-5-6-20-9-11-23(12-10-20)28-17-15-21-7-3-4-8-22(21)19-28/h3-4,7-14,18,27H,5-6,15-17,19H2,1-2H3