8-[azanyl-(2-oxidanyl-4-phenyl-butyl)phosphoryl]oxy-3-oxidanylidene-2-phenylazanyl-octanoic acid

Systemtic Name: 8-[azanyl-(2-oxidanyl-4-phenyl-butyl)phosphoryl]oxy-3-oxidanylidene-2-phenylazanyl-octanoic acid Openeye Name: 8-[amino-(2-hydroxy-4-phenyl-butyl)phosphoryl]oxy-2-anilino-3-oxo-octanoic acid CAS Name: 8-[amino-(2-hydroxy-4-phenylbutyl)phosphoryl]oxy-2-anilino-3-oxooctanoic acid IUPAC Name: 8-[amino-(2-hydroxy-4-phenylbutyl)phosphoryl]oxy-2-anilino-3-oxooctanoic acid Traditional Name: 8-[amino-(2-hydroxy-4-phenyl-butyl)phosphoryl]oxy-2-anilino-3-keto-caprylic acid Formula: C24H33N2O6P MolecularWeight: 476.502381

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(CP(=O)(N)OCCCCCC(=O)C(C(=O)O)NC2=CC=CC=C2)O

Isomeric SMILES

C1=CC=C(C=C1)CCC(CP(=O)(N)OCCCCCC(=O)C(C(=O)O)NC2=CC=CC=C2)O

InChI

InChI=1S/C24H33N2O6P/c25-33(31,18-21(27)16-15-19-10-4-1-5-11-19)32-17-9-3-8-14-22(28)23(24(29)30)26-20-12-6-2-7-13-20/h1-2,4-7,10-13,21,23,26-27H,3,8-9,14-18H2,(H2,25,31)(H,29,30)