[4-[(3-acetamido-5-oxidanylidene-icosanoyl)-oxidanyl-phosphanyl]-4-oxidanylidene-butyl]-methyl-azanium

Systemtic Name: [4-[(3-acetamido-5-oxidanylidene-icosanoyl)-oxidanyl-phosphanyl]-4-oxidanylidene-butyl]-methyl-azanium Openeye Name: [4-[(3-acetamido-5-oxo-icosanoyl)-hydroxy-phosphanyl]-4-oxo-butyl]-methyl-ammonium CAS Name: [4-[(3-acetamido-1,5-dioxoeicosyl)-hydroxyphosphino]-4-oxobutyl]-methylammonium IUPAC Name: [4-[(3-acetamido-5-oxoicosanoyl)-hydroxyphosphanyl]-4-oxobutyl]-methylazanium Traditional Name: [4-[(3-acetamido-5-keto-eicosanoyl)-hydroxy-phosphino]-4-keto-butyl]-methyl-ammonium Formula: C27H52N2O5P+ MolecularWeight: 515.685941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)CC(CC(=O)P(C(=O)CCC[NH2+]C)O)NC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)CC(CC(=O)P(C(=O)CCC[NH2+]C)O)NC(=O)C

InChI

InChI=1S/C27H51N2O5P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-18-25(31)21-24(29-23(2)30)22-27(33)35(34)26(32)19-17-20-28-3/h24,28,34H,4-22H2,1-3H3,(H,29,30)/p+1