[3-[(3-acetamido-5-oxidanylidene-henicosanoyl)-oxidanyl-phosphanyl]-3-oxidanylidene-propyl]-trimethyl-azanium

Systemtic Name: [3-[(3-acetamido-5-oxidanylidene-henicosanoyl)-oxidanyl-phosphanyl]-3-oxidanylidene-propyl]-trimethyl-azanium Openeye Name: [3-[(3-acetamido-5-oxo-henicosanoyl)-hydroxy-phosphanyl]-3-oxo-propyl]-trimethyl-ammonium CAS Name: [3-[(3-acetamido-1,5-dioxoheneicosyl)-hydroxyphosphino]-3-oxopropyl]-trimethylammonium IUPAC Name: [3-[(3-acetamido-5-oxohenicosanoyl)-hydroxyphosphanyl]-3-oxopropyl]-trimethylazanium Traditional Name: [3-[(3-acetamido-5-keto-heneicosanoyl)-hydroxy-phosphino]-3-keto-propyl]-trimethyl-ammonium Formula: C29H56N2O5P+ MolecularWeight: 543.739101

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H55N2O5P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-27(33)23-26(30-25(2)32)24-29(35)37(36)28(34)21-22-31(3,4)5/h26,36H,6-24H2,1-5H3/p+1