barium(2+); 2-bromoethyl (2-methoxy-3-octadecoxy-propyl) phosphate

Systemtic Name: barium(2+); 2-bromoethyl (2-methoxy-3-octadecoxy-propyl) phosphate Openeye Name: barium(2+); 2-bromoethyl (2-methoxy-3-octadecoxy-propyl) phosphate CAS Name: barium(2+); 2-bromoethyl (2-methoxy-3-octadecoxypropyl) phosphate IUPAC Name: barium(2+); 2-bromoethyl (2-methoxy-3-octadecoxypropyl) phosphate Traditional Name: barium(2+); 2-bromoethyl (2-methoxy-3-stearyloxy-propyl) phosphate Formula: C24H49BaBrO6P+ MolecularWeight: 681.847021

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COP(=O)([O-])OCCBr)OC.[Ba+2]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(COP(=O)([O-])OCCBr)OC.[Ba+2]

InChI

InChI=1S/C24H50BrO6P.Ba/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-29-22-24(28-2)23-31-32(26,27)30-21-19-25;/h24H,3-23H2,1-2H3,(H,26,27);/q;+2/p-1