[5-[[3-(butanoylamino)-5-oxidanylidene-henicosanoyl]-oxidanyl-phosphanyl]-5-oxidanylidene-pentyl]-dimethyl-azanium

Systemtic Name: [5-[[3-(butanoylamino)-5-oxidanylidene-henicosanoyl]-oxidanyl-phosphanyl]-5-oxidanylidene-pentyl]-dimethyl-azanium Openeye Name: [5-[[3-(butanoylamino)-5-oxo-henicosanoyl]-hydroxy-phosphanyl]-5-oxo-pentyl]-dimethyl-ammonium CAS Name: [5-[[1,5-dioxo-3-(1-oxobutylamino)heneicosyl]-hydroxyphosphino]-5-oxopentyl]-dimethylammonium IUPAC Name: [5-[[3-(butanoylamino)-5-oxohenicosanoyl]-hydroxyphosphanyl]-5-oxopentyl]-dimethylazanium Traditional Name: [5-[(3-butyramido-5-keto-heneicosanoyl)-hydroxy-phosphino]-5-keto-pentyl]-dimethyl-ammonium Formula: C32H62N2O5P+ MolecularWeight: 585.818841

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H61N2O5P/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-23-29(35)26-28(33-30(36)22-6-2)27-32(38)40(39)31(37)24-20-21-25-34(3)4/h28,39H,5-27H2,1-4H3,(H,33,36)/p+1