3-[2-azanyl-4-(hydroxymethyl)phenoxy]pentan-3-ylphosphonic acid

Systemtic Name: 3-[2-azanyl-4-(hydroxymethyl)phenoxy]pentan-3-ylphosphonic acid Openeye Name: [1-[2-amino-4-(hydroxymethyl)phenoxy]-1-ethyl-propyl]phosphonic acid CAS Name: 3-[2-amino-4-(hydroxymethyl)phenoxy]pentan-3-ylphosphonic acid IUPAC Name: 3-[2-amino-4-(hydroxymethyl)phenoxy]pentan-3-ylphosphonic acid Traditional Name: [1-(2-amino-4-methylol-phenoxy)-1-ethyl-propyl]phosphonic acid Formula: C12H20NO5P MolecularWeight: 289.264661

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(OC1=C(C=C(C=C1)CO)N)P(=O)(O)O

Isomeric SMILES

CCC(CC)(OC1=C(C=C(C=C1)CO)N)P(=O)(O)O

InChI

InChI=1S/C12H20NO5P/c1-3-12(4-2,19(15,16)17)18-11-6-5-9(8-14)7-10(11)13/h5-7,14H,3-4,8,13H2,1-2H3,(H2,15,16,17)