N-tert-butyl-2-(2-oxidanyl-4-phenyl-butyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ium-2-carboxamide

Systemtic Name: N-tert-butyl-2-(2-oxidanyl-4-phenyl-butyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ium-2-carboxamide Openeye Name: N-tert-butyl-2-(2-hydroxy-4-phenyl-butyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ium-2-carboxamide CAS Name: N-tert-butyl-2-(2-hydroxy-4-phenylbutyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ium-2-carboxamide IUPAC Name: N-tert-butyl-2-(2-hydroxy-4-phenylbutyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ium-2-carboxamide Traditional Name: N-tert-butyl-2-(2-hydroxy-4-phenyl-butyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ium-2-carboxamide Formula: C24H39N2O2+ MolecularWeight: 387.57866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)[N+]1(CCC2CCCCC2C1)CC(CCC3=CC=CC=C3)O

Isomeric SMILES

CC(C)(C)NC(=O)[N+]1(CCC2CCCCC2C1)CC(CCC3=CC=CC=C3)O

InChI

InChI=1S/C24H38N2O2/c1-24(2,3)25-23(28)26(16-15-20-11-7-8-12-21(20)17-26)18-22(27)14-13-19-9-5-4-6-10-19/h4-6,9-10,20-22,27H,7-8,11-18H2,1-3H3/p+1