2-[(3-phosphonophenyl)methylamino]ethanoic acid

Systemtic Name: 2-[(3-phosphonophenyl)methylamino]ethanoic acid Openeye Name: 2-[(3-phosphonophenyl)methylamino]acetic acid CAS Name: 2-[(3-phosphonophenyl)methylamino]acetic acid IUPAC Name: 2-[(3-phosphonophenyl)methylamino]acetic acid Traditional Name: 2-[(3-phosphonobenzyl)amino]acetic acid Formula: C9H12NO5P MolecularWeight: 245.169041

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)P(=O)(O)O)CNCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)P(=O)(O)O)CNCC(=O)O

InChI

InChI=1S/C9H12NO5P/c11-9(12)6-10-5-7-2-1-3-8(4-7)16(13,14)15/h1-4,10H,5-6H2,(H,11,12)(H2,13,14,15)