2-methyl-1-[6-oxidanyl-1-[[4-(1-piperidin-2-ylethoxy)phenyl]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one

Systemtic Name: 2-methyl-1-[6-oxidanyl-1-[[4-(1-piperidin-2-ylethoxy)phenyl]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one Openeye Name: 1-[6-hydroxy-1-[[4-[1-(2-piperidyl)ethoxy]phenyl]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-2-methyl-propan-1-one CAS Name: 1-[6-hydroxy-1-[[4-[1-(2-piperidinyl)ethoxy]phenyl]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-2-methyl-1-propanone IUPAC Name: 1-[6-hydroxy-1-[[4-(1-piperidin-2-ylethoxy)phenyl]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-2-methylpropan-1-one Traditional Name: 1-[6-hydroxy-1-[4-[1-(2-piperidyl)ethoxy]benzyl]-3,4-dihydro-1H-isoquinolin-2-yl]-2-methyl-propan-1-one Formula: C27H36N2O3 MolecularWeight: 436.58634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCC2=C(C1CC3=CC=C(C=C3)OC(C)C4CCCCN4)C=CC(=C2)O

Isomeric SMILES

CC(C)C(=O)N1CCC2=C(C1CC3=CC=C(C=C3)OC(C)C4CCCCN4)C=CC(=C2)O

InChI

InChI=1S/C27H36N2O3/c1-18(2)27(31)29-15-13-21-17-22(30)9-12-24(21)26(29)16-20-7-10-23(11-8-20)32-19(3)25-6-4-5-14-28-25/h7-12,17-19,25-26,28,30H,4-6,13-16H2,1-3H3