6-azanyl-2-[[2-methyl-1-(2-pyridin-2-ylethanoylamino)propyl]-oxidanyl-phosphoryl]oxy-hexanoic acid

Systemtic Name: 6-azanyl-2-[[2-methyl-1-(2-pyridin-2-ylethanoylamino)propyl]-oxidanyl-phosphoryl]oxy-hexanoic acid Openeye Name: 6-amino-2-[hydroxy-[2-methyl-1-[[2-(2-pyridyl)acetyl]amino]propyl]phosphoryl]oxy-hexanoic acid CAS Name: 6-amino-2-[hydroxy-[2-methyl-1-[[1-oxo-2-(2-pyridinyl)ethyl]amino]propyl]phosphoryl]oxyhexanoic acid IUPAC Name: 6-amino-2-[hydroxy-[2-methyl-1-[(2-pyridin-2-ylacetyl)amino]propyl]phosphoryl]oxyhexanoic acid Traditional Name: 6-amino-2-[hydroxy-[2-methyl-1-[[2-(2-pyridyl)acetyl]amino]propyl]phosphoryl]oxy-hexanoic acid Formula: C17H28N3O6P MolecularWeight: 401.394481

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(NC(=O)CC1=CC=CC=N1)P(=O)(O)OC(CCCCN)C(=O)O

Isomeric SMILES

CC(C)C(NC(=O)CC1=CC=CC=N1)P(=O)(O)OC(CCCCN)C(=O)O

InChI

InChI=1S/C17H28N3O6P/c1-12(2)16(20-15(21)11-13-7-4-6-10-19-13)27(24,25)26-14(17(22)23)8-3-5-9-18/h4,6-7,10,12,14,16H,3,5,8-9,11,18H2,1-2H3,(H,20,21)(H,22,23)(H,24,25)