[4-[(3-acetamido-5-oxidanylidene-henicosanoyl)-oxidanyl-phosphanyl]-4-oxidanylidene-butyl]-methyl-azanium

Systemtic Name: [4-[(3-acetamido-5-oxidanylidene-henicosanoyl)-oxidanyl-phosphanyl]-4-oxidanylidene-butyl]-methyl-azanium Openeye Name: [4-[(3-acetamido-5-oxo-henicosanoyl)-hydroxy-phosphanyl]-4-oxo-butyl]-methyl-ammonium CAS Name: [4-[(3-acetamido-1,5-dioxoheneicosyl)-hydroxyphosphino]-4-oxobutyl]-methylammonium IUPAC Name: [4-[(3-acetamido-5-oxohenicosanoyl)-hydroxyphosphanyl]-4-oxobutyl]-methylazanium Traditional Name: [4-[(3-acetamido-5-keto-heneicosanoyl)-hydroxy-phosphino]-4-keto-butyl]-methyl-ammonium Formula: C28H54N2O5P+ MolecularWeight: 529.712521

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(=O)CC(CC(=O)P(C(=O)CCC[NH2+]C)O)NC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCC(=O)CC(CC(=O)P(C(=O)CCC[NH2+]C)O)NC(=O)C

InChI

InChI=1S/C28H53N2O5P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-26(32)22-25(30-24(2)31)23-28(34)36(35)27(33)20-18-21-29-3/h25,29,35H,4-23H2,1-3H3,(H,30,31)/p+1