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

Systemtic Name: 6-azanyl-2-[[2-methyl-1-(2-phenylethanoylamino)propyl]-oxidanyl-phosphoryl]oxy-hexanoic acid Openeye Name: 6-amino-2-[hydroxy-[2-methyl-1-[(2-phenylacetyl)amino]propyl]phosphoryl]oxy-hexanoic acid CAS Name: 6-amino-2-[hydroxy-[2-methyl-1-[(1-oxo-2-phenylethyl)amino]propyl]phosphoryl]oxyhexanoic acid IUPAC Name: 6-amino-2-[hydroxy-[2-methyl-1-[(2-phenylacetyl)amino]propyl]phosphoryl]oxyhexanoic acid Traditional Name: 6-amino-2-[hydroxy-[2-methyl-1-[(2-phenylacetyl)amino]propyl]phosphoryl]oxy-hexanoic acid Formula: C18H29N2O6P MolecularWeight: 400.406421

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(NC(=O)CC1=CC=CC=C1)P(=O)(O)OC(CCCCN)C(=O)O

Isomeric SMILES

CC(C)C(NC(=O)CC1=CC=CC=C1)P(=O)(O)OC(CCCCN)C(=O)O

InChI

InChI=1S/C18H29N2O6P/c1-13(2)17(20-16(21)12-14-8-4-3-5-9-14)27(24,25)26-15(18(22)23)10-6-7-11-19/h3-5,8-9,13,15,17H,6-7,10-12,19H2,1-2H3,(H,20,21)(H,22,23)(H,24,25)