2-azanyl-3-phenyl-4-phosphono-butanoic acid hydrate

Systemtic Name: 2-azanyl-3-phenyl-4-phosphono-butanoic acid hydrate Openeye Name: 2-amino-3-phenyl-4-phosphono-butanoic acid hydrate CAS Name: 2-amino-3-phenyl-4-phosphonobutanoic acid hydrate IUPAC Name: 2-amino-3-phenyl-4-phosphonobutanoic acid hydrate Traditional Name: 2-amino-3-phenyl-4-phosphono-butyric acid hydrate Formula: C10H16NO6P MolecularWeight: 277.210901

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14NO5P.H2O/c11-9(10(12)13)8(6-17(14,15)16)7-4-2-1-3-5-7;/h1-5,8-9H,6,11H2,(H,12,13)(H2,14,15,16);1H2