2-[2,3-di(octa-3,5-diynoyloxy)propoxy-oxidanidyl-oxidanyl-phosphaniumyl]oxyethyl-methyl-azanium

Systemtic Name: 2-[2,3-di(octa-3,5-diynoyloxy)propoxy-oxidanidyl-oxidanyl-phosphaniumyl]oxyethyl-methyl-azanium Openeye Name: 2-[2,3-di(octa-3,5-diynoyloxy)propoxy-hydroxy-oxido-phosphaniumyl]oxyethyl-methyl-ammonium CAS Name: 2-[2,3-bis(1-oxoocta-3,5-diynoxy)propoxy-hydroxy-oxidophosphiniumyl]oxyethyl-methylammonium IUPAC Name: 2-[2,3-di(octa-3,5-diynoyloxy)propoxy-hydroxy-oxidophosphaniumyl]oxyethyl-methylazanium Traditional Name: 2-[2,3-di(octa-3,5-diynoyloxy)propoxy-hydroxy-oxido-phosphiniumyl]oxyethyl-methyl-ammonium Formula: C22H29NO8P+ MolecularWeight: 466.441321

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CC#CCC(=O)OCC(CO[P+](O)([O-])OCC[NH2+]C)OC(=O)CC#CC#CCC

Isomeric SMILES

CCC#CC#CCC(=O)OCC(CO[P+](O)([O-])OCC[NH2+]C)OC(=O)CC#CC#CCC

InChI

InChI=1S/C22H28NO8P/c1-4-6-8-10-12-14-21(24)28-18-20(19-30-32(26,27)29-17-16-23-3)31-22(25)15-13-11-9-7-5-2/h20,23H,4-5,14-19H2,1-3H3,(H,26,27)/p+1