(8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) octadecyl hydrogen phosphate

Systemtic Name: (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) octadecyl hydrogen phosphate Openeye Name: (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) octadecyl hydrogen phosphate CAS Name: (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) octadecyl hydrogen phosphate IUPAC Name: (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) octadecyl hydrogen phosphate Traditional Name: (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) stearyl hydrogen phosphate Formula: C27H55NO4P+ MolecularWeight: 488.703661

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOP(=O)(O)OC1CC2CCC(C1)[N+]2(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOP(=O)(O)OC1CC2CCC(C1)[N+]2(C)C

InChI

InChI=1S/C27H54NO4P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-31-33(29,30)32-27-23-25-20-21-26(24-27)28(25,2)3/h25-27H,4-24H2,1-3H3/p+1