(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-oxidanyl-2-phenyl-ethanoate; sulfuric acid

Systemtic Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-oxidanyl-2-phenyl-ethanoate; sulfuric acid Openeye Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-hydroxy-2-phenyl-acetate; sulfuric acid CAS Name: 2-hydroxy-2-phenylacetic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester; sulfuric acid IUPAC Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-hydroxy-2-phenylacetate; sulfuric acid Traditional Name: 2-hydroxy-2-phenyl-acetic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester; sulfuric acid Formula: C32H44N2O10S MolecularWeight: 648.76416

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2CCC1CC(C2)OC(=O)C(C3=CC=CC=C3)O.CN1C2CCC1CC(C2)OC(=O)C(C3=CC=CC=C3)O.OS(=O)(=O)O

Isomeric SMILES

CN1C2CCC1CC(C2)OC(=O)C(C3=CC=CC=C3)O.CN1C2CCC1CC(C2)OC(=O)C(C3=CC=CC=C3)O.OS(=O)(=O)O

InChI

InChI=1S/2C16H21NO3.H2O4S/c2*1-17-12-7-8-13(17)10-14(9-12)20-16(19)15(18)11-5-3-2-4-6-11;1-5(2,3)4/h2*2-6,12-15,18H,7-10H2,1H3;(H2,1,2,3,4)