4-oxidanylidene-3-(2-phenylmethoxyethyl)-3,9-diazabicyclo[3.3.1]nonane-9-carboxylic acid

Systemtic Name: 4-oxidanylidene-3-(2-phenylmethoxyethyl)-3,9-diazabicyclo[3.3.1]nonane-9-carboxylic acid Openeye Name: 3-(2-benzyloxyethyl)-4-oxo-3,9-diazabicyclo[3.3.1]nonane-9-carboxylic acid CAS Name: 4-oxo-3-(2-phenylmethoxyethyl)-3,9-diazabicyclo[3.3.1]nonane-9-carboxylic acid IUPAC Name: 4-oxo-3-(2-phenylmethoxyethyl)-3,9-diazabicyclo[3.3.1]nonane-9-carboxylic acid Traditional Name: 3-(2-benzoxyethyl)-4-keto-3,9-diazabicyclo[3.3.1]nonane-9-carboxylic acid Formula: C17H22N2O4 MolecularWeight: 318.36758

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CN(C(=O)C(C1)N2C(=O)O)CCOCC3=CC=CC=C3

Isomeric SMILES

C1CC2CN(C(=O)C(C1)N2C(=O)O)CCOCC3=CC=CC=C3

InChI

InChI=1S/C17H22N2O4/c20-16-15-8-4-7-14(19(15)17(21)22)11-18(16)9-10-23-12-13-5-2-1-3-6-13/h1-3,5-6,14-15H,4,7-12H2,(H,21,22)