2-azanyl-3-(4-hydroxyphenyl)propanoic acid; iron

Systemtic Name: 2-azanyl-3-(4-hydroxyphenyl)propanoic acid; iron Openeye Name: 2-amino-3-(4-hydroxyphenyl)propanoic acid; iron CAS Name: 2-amino-3-(4-hydroxyphenyl)propanoic acid; iron IUPAC Name: 2-amino-3-(4-hydroxyphenyl)propanoic acid; iron Traditional Name: 2-amino-3-(4-hydroxyphenyl)propionic acid; iron Formula: C18H22FeN2O6 MolecularWeight: 418.22208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)O)N)O.C1=CC(=CC=C1CC(C(=O)O)N)O.[Fe]

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)O)N)O.C1=CC(=CC=C1CC(C(=O)O)N)O.[Fe]

InChI

InChI=1S/2C9H11NO3.Fe/c2*10-8(9(12)13)5-6-1-3-7(11)4-2-6;/h2*1-4,8,11H,5,10H2,(H,12,13);