2-[bis(phosphonomethyl)amino]-3-(4-hydroxyphenyl)propanoic acid

Systemtic Name: 2-[bis(phosphonomethyl)amino]-3-(4-hydroxyphenyl)propanoic acid Openeye Name: 2-[bis(phosphonomethyl)amino]-3-(4-hydroxyphenyl)propanoic acid CAS Name: 2-[bis(phosphonomethyl)amino]-3-(4-hydroxyphenyl)propanoic acid IUPAC Name: 2-[bis(phosphonomethyl)amino]-3-(4-hydroxyphenyl)propanoic acid Traditional Name: 2-[bis(phosphonomethyl)amino]-3-(4-hydroxyphenyl)propionic acid Formula: C11H17NO9P2 MolecularWeight: 369.201502

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)O)N(CP(=O)(O)O)CP(=O)(O)O)O

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)O)N(CP(=O)(O)O)CP(=O)(O)O)O

InChI

InChI=1S/C11H17NO9P2/c13-9-3-1-8(2-4-9)5-10(11(14)15)12(6-22(16,17)18)7-23(19,20)21/h1-4,10,13H,5-7H2,(H,14,15)(H2,16,17,18)(H2,19,20,21)