[(3R)-3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)piperidin-1-yl]-(2-methylpyrazol-3-yl)methanone

Systemtic Name: [(3R)-3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)piperidin-1-yl]-(2-methylpyrazol-3-yl)methanone Openeye Name: [(3R)-3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-piperidyl]-(2-methylpyrazol-3-yl)methanone CAS Name: [(3R)-3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-piperidinyl]-(2-methyl-3-pyrazolyl)methanone IUPAC Name: [(3R)-3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)piperidin-1-yl]-(2-methylpyrazol-3-yl)methanone Traditional Name: [(3R)-3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)piperidino]-(2-methylpyrazol-3-yl)methanone Formula: C21H28N4O3 MolecularWeight: 384.47202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C(=O)N2CCCC(C2)N3CCC4=CC(=C(C=C4C3)OC)OC

Isomeric SMILES

CN1C(=CC=N1)C(=O)N2CCC[C@H](C2)N3CCC4=CC(=C(C=C4C3)OC)OC

InChI

InChI=1S/C21H28N4O3/c1-23-18(6-8-22-23)21(26)25-9-4-5-17(14-25)24-10-7-15-11-19(27-2)20(28-3)12-16(15)13-24/h6,8,11-12,17H,4-5,7,9-10,13-14H2,1-3H3/t17-/m1/s1