1-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)piperidin-1-yl]-3-(2,5-dimethylphenoxy)propan-1-one

Systemtic Name: 1-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)piperidin-1-yl]-3-(2,5-dimethylphenoxy)propan-1-one Openeye Name: 1-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1-piperidyl]-3-(2,5-dimethylphenoxy)propan-1-one CAS Name: 1-[4-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-1-piperidinyl]-3-(2,5-dimethylphenoxy)-1-propanone IUPAC Name: 1-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)piperidin-1-yl]-3-(2,5-dimethylphenoxy)propan-1-one Traditional Name: 1-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)piperidino]-3-(2,5-dimethylphenoxy)propan-1-one Formula: C26H32N2O3 MolecularWeight: 420.54388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCCC(=O)N2CCC(CC2)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCCC(=O)N2CCC(CC2)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C26H32N2O3/c1-19-7-8-20(2)24(17-19)31-16-12-25(29)27-13-10-22(11-14-27)26(30)28-15-9-21-5-3-4-6-23(21)18-28/h3-8,17,22H,9-16,18H2,1-2H3