4-[[2-[oxidanyl(4-phenylbutyl)phosphoryl]oxy-3-phenyl-propanoyl]amino]benzoic acid

Systemtic Name: 4-[[2-[oxidanyl(4-phenylbutyl)phosphoryl]oxy-3-phenyl-propanoyl]amino]benzoic acid Openeye Name: 4-[[2-[hydroxy(4-phenylbutyl)phosphoryl]oxy-3-phenyl-propanoyl]amino]benzoic acid CAS Name: 4-[[2-[hydroxy(4-phenylbutyl)phosphoryl]oxy-1-oxo-3-phenylpropyl]amino]benzoic acid IUPAC Name: 4-[[2-[hydroxy(4-phenylbutyl)phosphoryl]oxy-3-phenylpropanoyl]amino]benzoic acid Traditional Name: 4-[[2-[hydroxy(4-phenylbutyl)phosphoryl]oxy-3-phenyl-propanoyl]amino]benzoic acid Formula: C26H28NO6P MolecularWeight: 481.477381

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCP(=O)(O)OC(CC2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCCP(=O)(O)OC(CC2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C26H28NO6P/c28-25(27-23-16-14-22(15-17-23)26(29)30)24(19-21-12-5-2-6-13-21)33-34(31,32)18-8-7-11-20-9-3-1-4-10-20/h1-6,9-10,12-17,24H,7-8,11,18-19H2,(H,27,28)(H,29,30)(H,31,32)