3-phenylmethoxycarbonyl-3-azabicyclo[2.2.2]octane-2-carboxylic acid

Systemtic Name: 3-phenylmethoxycarbonyl-3-azabicyclo[2.2.2]octane-2-carboxylic acid Openeye Name: 3-benzyloxycarbonyl-3-azabicyclo[2.2.2]octane-2-carboxylic acid CAS Name: 3-phenylmethoxycarbonyl-3-azabicyclo[2.2.2]octane-2-carboxylic acid IUPAC Name: 3-phenylmethoxycarbonyl-3-azabicyclo[2.2.2]octane-2-carboxylic acid Traditional Name: 3-carbobenzoxy-3-azabicyclo[2.2.2]octane-2-carboxylic acid Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CCC1C(N2C(=O)OCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CC2CCC1C(N2C(=O)OCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C16H19NO4/c18-15(19)14-12-6-8-13(9-7-12)17(14)16(20)21-10-11-4-2-1-3-5-11/h1-5,12-14H,6-10H2,(H,18,19)