6-azanyl-2-[[2-methyl-1-(5-oxidanylidenehexanoylamino)propyl]-oxidanyl-phosphoryl]oxy-hexanoic acid

Systemtic Name: 6-azanyl-2-[[2-methyl-1-(5-oxidanylidenehexanoylamino)propyl]-oxidanyl-phosphoryl]oxy-hexanoic acid Openeye Name: 6-amino-2-[hydroxy-[2-methyl-1-(5-oxohexanoylamino)propyl]phosphoryl]oxy-hexanoic acid CAS Name: 6-amino-2-[[1-(1,5-dioxohexylamino)-2-methylpropyl]-hydroxyphosphoryl]oxyhexanoic acid IUPAC Name: 6-amino-2-[hydroxy-[2-methyl-1-(5-oxohexanoylamino)propyl]phosphoryl]oxyhexanoic acid Traditional Name: 6-amino-2-[hydroxy-[1-(5-ketohexanoylamino)-2-methyl-propyl]phosphoryl]oxy-hexanoic acid Formula: C16H31N2O7P MolecularWeight: 394.400301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(NC(=O)CCCC(=O)C)P(=O)(O)OC(CCCCN)C(=O)O

Isomeric SMILES

CC(C)C(NC(=O)CCCC(=O)C)P(=O)(O)OC(CCCCN)C(=O)O

InChI

InChI=1S/C16H31N2O7P/c1-11(2)15(18-14(20)9-6-7-12(3)19)26(23,24)25-13(16(21)22)8-4-5-10-17/h11,13,15H,4-10,17H2,1-3H3,(H,18,20)(H,21,22)(H,23,24)