methyl-[2-[[2-[(2-octadecoxyphenyl)methyl]-4-oxidanylidene-pentoxy]-oxidanyl-phosphoryl]oxyethyl]azanium

Systemtic Name: methyl-[2-[[2-[(2-octadecoxyphenyl)methyl]-4-oxidanylidene-pentoxy]-oxidanyl-phosphoryl]oxyethyl]azanium Openeye Name: 2-[hydroxy-[2-[(2-octadecoxyphenyl)methyl]-4-oxo-pentoxy]phosphoryl]oxyethyl-methyl-ammonium CAS Name: 2-[hydroxy-[2-[(2-octadecoxyphenyl)methyl]-4-oxopentoxy]phosphoryl]oxyethyl-methylammonium IUPAC Name: 2-[hydroxy-[2-[(2-octadecoxyphenyl)methyl]-4-oxopentoxy]phosphoryl]oxyethyl-methylazanium Traditional Name: 2-[hydroxy-[4-keto-2-(2-stearyloxybenzyl)pentoxy]phosphoryl]oxyethyl-methyl-ammonium Formula: C33H61NO6P+ MolecularWeight: 598.814301

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC=CC=C1CC(CC(=O)C)COP(=O)(O)OCC[NH2+]C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=CC=C1CC(CC(=O)C)COP(=O)(O)OCC[NH2+]C

InChI

InChI=1S/C33H60NO6P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-25-38-33-23-20-19-22-32(33)28-31(27-30(2)35)29-40-41(36,37)39-26-24-34-3/h19-20,22-23,31,34H,4-18,21,24-29H2,1-3H3,(H,36,37)/p+1