1,4,6-tris(oxidanylidene)-9-phenylmethoxy-5-azoniaspiro[4.4]nonane-9-carboxylic acid

Systemtic Name: 1,4,6-tris(oxidanylidene)-9-phenylmethoxy-5-azoniaspiro[4.4]nonane-9-carboxylic acid Openeye Name: 9-benzyloxy-1,4,6-trioxo-5-azoniaspiro[4.4]nonane-9-carboxylic acid CAS Name: 1,4,6-trioxo-9-phenylmethoxy-5-azoniaspiro[4.4]nonane-9-carboxylic acid IUPAC Name: 1,4,6-trioxo-9-phenylmethoxy-5-azoniaspiro[4.4]nonane-9-carboxylic acid Traditional Name: 9-benzoxy-1,4,6-triketo-5-azoniaspiro[4.4]nonane-9-carboxylic acid Formula: C16H16NO6+ MolecularWeight: 318.30134

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)[N+]2(C1=O)C(=O)CCC2(C(=O)O)OCC3=CC=CC=C3

Isomeric SMILES

C1CC(=O)[N+]2(C1=O)C(=O)CCC2(C(=O)O)OCC3=CC=CC=C3

InChI

InChI=1S/C16H15NO6/c18-12-6-7-13(19)17(12)14(20)8-9-16(17,15(21)22)23-10-11-4-2-1-3-5-11/h1-5H,6-10H2/p+1