N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-4-methoxy-2,3,6-trimethyl-benzenesulfonamide

Systemtic Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-4-methoxy-2,3,6-trimethyl-benzenesulfonamide Openeye Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-4-methoxy-2,3,6-trimethyl-benzenesulfonamide CAS Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-4-methoxy-2,3,6-trimethylbenzenesulfonamide IUPAC Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-4-methoxy-2,3,6-trimethylbenzenesulfonamide Traditional Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-4-methoxy-2,3,6-trimethyl-benzenesulfonamide Formula: C22H30N2O3S MolecularWeight: 402.5502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1S(=O)(=O)NCCCN2CCC3=CC=CC=C3C2)C)C)OC

Isomeric SMILES

CC1=CC(=C(C(=C1S(=O)(=O)NCCCN2CCC3=CC=CC=C3C2)C)C)OC

InChI

InChI=1S/C22H30N2O3S/c1-16-14-21(27-4)17(2)18(3)22(16)28(25,26)23-11-7-12-24-13-10-19-8-5-6-9-20(19)15-24/h5-6,8-9,14,23H,7,10-13,15H2,1-4H3