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

Systemtic Name: 6-azanyl-2-[[1-[(2-azanyl-2-phenyl-ethanoyl)amino]-2-methyl-propyl]-oxidanyl-phosphoryl]oxy-hexanoic acid Openeye Name: 6-amino-2-[[1-[(2-amino-2-phenyl-acetyl)amino]-2-methyl-propyl]-hydroxy-phosphoryl]oxy-hexanoic acid CAS Name: 6-amino-2-[[1-[(2-amino-1-oxo-2-phenylethyl)amino]-2-methylpropyl]-hydroxyphosphoryl]oxyhexanoic acid IUPAC Name: 6-amino-2-[[1-[(2-amino-2-phenylacetyl)amino]-2-methylpropyl]-hydroxyphosphoryl]oxyhexanoic acid Traditional Name: 6-amino-2-[[1-[(2-amino-2-phenyl-acetyl)amino]-2-methyl-propyl]-hydroxy-phosphoryl]oxy-hexanoic acid Formula: C18H30N3O6P MolecularWeight: 415.421061

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H30N3O6P/c1-12(2)17(21-16(22)15(20)13-8-4-3-5-9-13)28(25,26)27-14(18(23)24)10-6-7-11-19/h3-5,8-9,12,14-15,17H,6-7,10-11,19-20H2,1-2H3,(H,21,22)(H,23,24)(H,25,26)