(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 9-oxidanylidenebicyclo[3.3.1]nonane-3-carboxylate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 9-oxidanylidenebicyclo[3.3.1]nonane-3-carboxylate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) 9-oxobicyclo[3.3.1]nonane-3-carboxylate CAS Name: 9-oxo-3-bicyclo[3.3.1]nonanecarboxylic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) 9-oxobicyclo[3.3.1]nonane-3-carboxylate Traditional Name: 9-ketobicyclo[3.3.1]nonane-3-carboxylic acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(CC(C1)C2=O)C(=O)OC(C3=CC=CC=C3)C(=O)N

Isomeric SMILES

C1CC2CC(CC(C1)C2=O)C(=O)OC(C3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C18H21NO4/c19-17(21)16(11-5-2-1-3-6-11)23-18(22)14-9-12-7-4-8-13(10-14)15(12)20/h1-3,5-6,12-14,16H,4,7-10H2,(H2,19,21)