2-[3-(4-phenylphenyl)propanoylamino]-3-[2-(phosphonomethylamino)phenyl]propanoic acid

Systemtic Name: 2-[3-(4-phenylphenyl)propanoylamino]-3-[2-(phosphonomethylamino)phenyl]propanoic acid Openeye Name: 2-[3-(4-phenylphenyl)propanoylamino]-3-[2-(phosphonomethylamino)phenyl]propanoic acid CAS Name: 2-[[1-oxo-3-(4-phenylphenyl)propyl]amino]-3-[2-(phosphonomethylamino)phenyl]propanoic acid IUPAC Name: 2-[3-(4-phenylphenyl)propanoylamino]-3-[2-(phosphonomethylamino)phenyl]propanoic acid Traditional Name: 2-[3-(4-phenylphenyl)propanoylamino]-3-[2-(phosphonomethylamino)phenyl]propionic acid Formula: C25H27N2O6P MolecularWeight: 482.465441

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)CCC(=O)NC(CC3=CC=CC=C3NCP(=O)(O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)CCC(=O)NC(CC3=CC=CC=C3NCP(=O)(O)O)C(=O)O

InChI

InChI=1S/C25H27N2O6P/c28-24(15-12-18-10-13-20(14-11-18)19-6-2-1-3-7-19)27-23(25(29)30)16-21-8-4-5-9-22(21)26-17-34(31,32)33/h1-11,13-14,23,26H,12,15-17H2,(H,27,28)(H,29,30)(H2,31,32,33)