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

Systemtic Name: trimethyl-[3-[[6-methyl-5-oxidanylidene-3-(propanoylamino)henicosanoyl]-oxidanyl-phosphanyl]-3-oxidanylidene-propyl]azanium Openeye Name: [3-[hydroxy-[6-methyl-5-oxo-3-(propanoylamino)henicosanoyl]phosphanyl]-3-oxo-propyl]-trimethyl-ammonium CAS Name: [3-[hydroxy-[6-methyl-1,5-dioxo-3-(1-oxopropylamino)heneicosyl]phosphino]-3-oxopropyl]-trimethylammonium IUPAC Name: [3-[hydroxy-[6-methyl-5-oxo-3-(propanoylamino)henicosanoyl]phosphanyl]-3-oxopropyl]-trimethylazanium Traditional Name: [3-[hydroxy-(5-keto-6-methyl-3-propionamido-heneicosanoyl)phosphino]-3-keto-propyl]-trimethyl-ammonium Formula: C31H60N2O5P+ MolecularWeight: 571.792261

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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)CC

Isomeric SMILES

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

InChI

InChI=1S/C31H59N2O5P/c1-7-9-10-11-12-13-14-15-16-17-18-19-20-21-26(3)28(34)24-27(32-29(35)8-2)25-31(37)39(38)30(36)22-23-33(4,5)6/h26-27,38H,7-25H2,1-6H3/p+1