4-phenyl-8-azabicyclo[3.2.1]octane-3-carboxylate sulfate

Systemtic Name: 4-phenyl-8-azabicyclo[3.2.1]octane-3-carboxylate sulfate Openeye Name: 4-phenyl-8-azabicyclo[3.2.1]octane-3-carboxylate sulfate CAS Name: 4-phenyl-8-azabicyclo[3.2.1]octane-3-carboxylate sulfate IUPAC Name: 4-phenyl-8-azabicyclo[3.2.1]octane-3-carboxylate sulfate Traditional Name: 4-phenyl-8-azabicyclo[3.2.1]octane-3-carboxylate sulfate Formula: C14H16NO6S-3 MolecularWeight: 326.34494

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(C(CC1N2)C(=O)[O-])C3=CC=CC=C3.[O-]S(=O)(=O)[O-]

Isomeric SMILES

C1CC2C(C(CC1N2)C(=O)[O-])C3=CC=CC=C3.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C14H17NO2.H2O4S/c16-14(17)11-8-10-6-7-12(15-10)13(11)9-4-2-1-3-5-9;1-5(2,3)4/h1-5,10-13,15H,6-8H2,(H,16,17);(H2,1,2,3,4)/p-3