2-[4-(2-azanylethylcarbamoyl)-3-methoxy-phenoxy]ethylphosphonic acid

Systemtic Name: 2-[4-(2-azanylethylcarbamoyl)-3-methoxy-phenoxy]ethylphosphonic acid Openeye Name: 2-[4-(2-aminoethylcarbamoyl)-3-methoxy-phenoxy]ethylphosphonic acid CAS Name: 2-[4-[(2-aminoethylamino)-oxomethyl]-3-methoxyphenoxy]ethylphosphonic acid IUPAC Name: 2-[4-(2-aminoethylcarbamoyl)-3-methoxyphenoxy]ethylphosphonic acid Traditional Name: 2-[4-(2-aminoethylcarbamoyl)-3-methoxy-phenoxy]ethylphosphonic acid Formula: C12H19N2O6P MolecularWeight: 318.262821

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)OCCP(=O)(O)O)C(=O)NCCN

Isomeric SMILES

COC1=C(C=CC(=C1)OCCP(=O)(O)O)C(=O)NCCN

InChI

InChI=1S/C12H19N2O6P/c1-19-11-8-9(20-6-7-21(16,17)18)2-3-10(11)12(15)14-5-4-13/h2-3,8H,4-7,13H2,1H3,(H,14,15)(H2,16,17,18)