3-[[3-(3-methoxy-4-phenyl-phenyl)-2-(phosphonomethylamino)propanoyl]amino]propanoic acid

Systemtic Name: 3-[[3-(3-methoxy-4-phenyl-phenyl)-2-(phosphonomethylamino)propanoyl]amino]propanoic acid Openeye Name: 3-[[3-(3-methoxy-4-phenyl-phenyl)-2-(phosphonomethylamino)propanoyl]amino]propanoic acid CAS Name: 3-[[3-(3-methoxy-4-phenylphenyl)-1-oxo-2-(phosphonomethylamino)propyl]amino]propanoic acid IUPAC Name: 3-[[3-(3-methoxy-4-phenylphenyl)-2-(phosphonomethylamino)propanoyl]amino]propanoic acid Traditional Name: 3-[[3-(3-methoxy-4-phenyl-phenyl)-2-(phosphonomethylamino)propanoyl]amino]propionic acid Formula: C20H25N2O7P MolecularWeight: 436.395461

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC(C(=O)NCCC(=O)O)NCP(=O)(O)O)C2=CC=CC=C2

Isomeric SMILES

COC1=C(C=CC(=C1)CC(C(=O)NCCC(=O)O)NCP(=O)(O)O)C2=CC=CC=C2

InChI

InChI=1S/C20H25N2O7P/c1-29-18-12-14(7-8-16(18)15-5-3-2-4-6-15)11-17(22-13-30(26,27)28)20(25)21-10-9-19(23)24/h2-8,12,17,22H,9-11,13H2,1H3,(H,21,25)(H,23,24)(H2,26,27,28)