6-[(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)amino]hexanoic acid

Systemtic Name: 6-[(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)amino]hexanoic acid Openeye Name: 6-[(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)amino]hexanoic acid CAS Name: 6-[(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)amino]hexanoic acid IUPAC Name: 6-[(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)amino]hexanoic acid Traditional Name: 6-[(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)amino]hexanoic acid Formula: C19H28N2O4 MolecularWeight: 348.43662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC(=C(C=C2C(=N1)NCCCCCC(=O)O)OC)OC)C

Isomeric SMILES

CC1(CC2=CC(=C(C=C2C(=N1)NCCCCCC(=O)O)OC)OC)C

InChI

InChI=1S/C19H28N2O4/c1-19(2)12-13-10-15(24-3)16(25-4)11-14(13)18(21-19)20-9-7-5-6-8-17(22)23/h10-11H,5-9,12H2,1-4H3,(H,20,21)(H,22,23)