[1-(2,3-dimethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-6-yl)-5-methyl-piperidin-3-yl] benzoate

Systemtic Name: [1-(2,3-dimethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-6-yl)-5-methyl-piperidin-3-yl] benzoate Openeye Name: [1-(2,3-dimethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-6-yl)-5-methyl-3-piperidyl] benzoate CAS Name: benzoic acid [1-(2,3-dimethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-6-yl)-5-methyl-3-piperidinyl] ester IUPAC Name: [1-(2,3-dimethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-6-yl)-5-methylpiperidin-3-yl] benzoate Traditional Name: benzoic acid [1-(2,3-dimethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-6-yl)-5-methyl-3-piperidyl] ester Formula: C24H36N2O2 MolecularWeight: 384.55484

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C2CCC3CN(C(CC3C2)C)C)OC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1CC(CN(C1)C2CCC3CN(C(CC3C2)C)C)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H36N2O2/c1-17-11-23(28-24(27)19-7-5-4-6-8-19)16-26(14-17)22-10-9-20-15-25(3)18(2)12-21(20)13-22/h4-8,17-18,20-23H,9-16H2,1-3H3