[4-[[3-(butanoylamino)-5-oxidanylidene-icosanoyl]-oxidanyl-phosphanyl]-4-oxidanylidene-butyl]-dimethyl-azanium

Systemtic Name: [4-[[3-(butanoylamino)-5-oxidanylidene-icosanoyl]-oxidanyl-phosphanyl]-4-oxidanylidene-butyl]-dimethyl-azanium Openeye Name: [4-[[3-(butanoylamino)-5-oxo-icosanoyl]-hydroxy-phosphanyl]-4-oxo-butyl]-dimethyl-ammonium CAS Name: [4-[[1,5-dioxo-3-(1-oxobutylamino)eicosyl]-hydroxyphosphino]-4-oxobutyl]-dimethylammonium IUPAC Name: [4-[[3-(butanoylamino)-5-oxoicosanoyl]-hydroxyphosphanyl]-4-oxobutyl]-dimethylazanium Traditional Name: [4-[(3-butyramido-5-keto-eicosanoyl)-hydroxy-phosphino]-4-keto-butyl]-dimethyl-ammonium Formula: C30H58N2O5P+ MolecularWeight: 557.765681

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)CC(CC(=O)P(C(=O)CCC[NH+](C)C)O)NC(=O)CCC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)CC(CC(=O)P(C(=O)CCC[NH+](C)C)O)NC(=O)CCC

InChI

InChI=1S/C30H57N2O5P/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-21-27(33)24-26(31-28(34)20-6-2)25-30(36)38(37)29(35)22-19-23-32(3)4/h26,37H,5-25H2,1-4H3,(H,31,34)/p+1