2-[[4-(3-dodecoxyphenyl)-2-methanoyloxy-butoxy]-oxidanyl-phosphanyl]oxyethyl-methyl-azanium

Systemtic Name: 2-[[4-(3-dodecoxyphenyl)-2-methanoyloxy-butoxy]-oxidanyl-phosphanyl]oxyethyl-methyl-azanium Openeye Name: 2-[[4-(3-dodecoxyphenyl)-2-formyloxy-butoxy]-hydroxy-phosphanyl]oxyethyl-methyl-ammonium CAS Name: 2-[[4-(3-dodecoxyphenyl)-2-formyloxybutoxy]-hydroxyphosphino]oxyethyl-methylammonium IUPAC Name: 2-[[4-(3-dodecoxyphenyl)-2-formyloxybutoxy]-hydroxyphosphanyl]oxyethyl-methylazanium Traditional Name: 2-[[2-formyloxy-4-(3-lauryloxyphenyl)butoxy]-hydroxy-phosphino]oxyethyl-methyl-ammonium Formula: C26H47NO6P+ MolecularWeight: 500.628241

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=CC(=C1)CCC(COP(O)OCC[NH2+]C)OC=O

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=CC(=C1)CCC(COP(O)OCC[NH2+]C)OC=O

InChI

InChI=1S/C26H46NO6P/c1-3-4-5-6-7-8-9-10-11-12-19-30-25-15-13-14-24(21-25)16-17-26(31-23-28)22-33-34(29)32-20-18-27-2/h13-15,21,23,26-27,29H,3-12,16-20,22H2,1-2H3/p+1