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

Systemtic Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-4-methoxy-2,3,6-trimethyl-benzenesulfonamide Openeye Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-4-methoxy-2,3,6-trimethyl-benzenesulfonamide CAS Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-4-methoxy-2,3,6-trimethylbenzenesulfonamide IUPAC Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-4-methoxy-2,3,6-trimethylbenzenesulfonamide Traditional Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-4-methoxy-2,3,6-trimethyl-benzenesulfonamide Formula: C23H32N2O3S MolecularWeight: 416.57678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1S(=O)(=O)NCCCCN2CCC3=CC=CC=C3C2)C)C)OC

Isomeric SMILES

CC1=CC(=C(C(=C1S(=O)(=O)NCCCCN2CCC3=CC=CC=C3C2)C)C)OC

InChI

InChI=1S/C23H32N2O3S/c1-17-15-22(28-4)18(2)19(3)23(17)29(26,27)24-12-7-8-13-25-14-11-20-9-5-6-10-21(20)16-25/h5-6,9-10,15,24H,7-8,11-14,16H2,1-4H3