[3-[[3-(butanoylamino)-6-methyl-5-oxidanylidene-henicosanoyl]-oxidanyl-phosphanyl]-3-oxidanylidene-propyl]-trimethyl-azanium

Systemtic Name: [3-[[3-(butanoylamino)-6-methyl-5-oxidanylidene-henicosanoyl]-oxidanyl-phosphanyl]-3-oxidanylidene-propyl]-trimethyl-azanium Openeye Name: [3-[[3-(butanoylamino)-6-methyl-5-oxo-henicosanoyl]-hydroxy-phosphanyl]-3-oxo-propyl]-trimethyl-ammonium CAS Name: [3-[hydroxy-[6-methyl-1,5-dioxo-3-(1-oxobutylamino)heneicosyl]phosphino]-3-oxopropyl]-trimethylammonium IUPAC Name: [3-[[3-(butanoylamino)-6-methyl-5-oxohenicosanoyl]-hydroxyphosphanyl]-3-oxopropyl]-trimethylazanium Traditional Name: [3-[(3-butyramido-5-keto-6-methyl-heneicosanoyl)-hydroxy-phosphino]-3-keto-propyl]-trimethyl-ammonium Formula: C32H62N2O5P+ MolecularWeight: 585.818841

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H61N2O5P/c1-7-9-10-11-12-13-14-15-16-17-18-19-20-22-27(3)29(35)25-28(33-30(36)21-8-2)26-32(38)40(39)31(37)23-24-34(4,5)6/h27-28,39H,7-26H2,1-6H3/p+1