ethoxy-oxidanylidene-(phosphonomethyl)phosphanium; spiro[1-azoniacyclododecane-1,2'-isoindol-2-ium]-1',3'-dione

Systemtic Name: ethoxy-oxidanylidene-(phosphonomethyl)phosphanium; spiro[1-azoniacyclododecane-1,2'-isoindol-2-ium]-1',3'-dione Openeye Name: ethoxy-oxo-(phosphonomethyl)phosphonium; spiro[azoniacyclododecane-1,2'-isoindol-2-ium]-1',3'-dione CAS Name: ethoxy-oxo-(phosphonomethyl)phosphonium; spiro[azoniacyclododecane-1,2'-isoindol-2-ium]-1',3'-dione IUPAC Name: ethoxy-oxo-(phosphonomethyl)phosphanium; spiro[azoniacyclododecane-1,2'-isoindol-2-ium]-1',3'-dione Traditional Name: ethoxy-keto-(phosphonomethyl)phosphonium; spiro[azoniacyclododecane-1,2'-isoindol-2-ium]-1',3'-quinone Formula: C22H35NO7P2+2 MolecularWeight: 487.463322

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Descriptors Computed from Structure

Canonical SMILES:

CCO[P+](=O)CP(=O)(O)O.C1CCCCC[N+]2(CCCCC1)C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCO[P+](=O)CP(=O)(O)O.C1CCCCC[N+]2(CCCCC1)C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C19H26NO2.C3H8O5P2/c21-18-16-12-8-9-13-17(16)19(22)20(18)14-10-6-4-2-1-3-5-7-11-15-20;1-2-8-9(4)3-10(5,6)7/h8-9,12-13H,1-7,10-11,14-15H2;2-3H2,1H3,(H-,5,6,7)/q+1;/p+1