2-[[1-(2-ethylphenyl)-1-phosphono-propyl]-methanoyl-amino]propanedioic acid

Systemtic Name: 2-[[1-(2-ethylphenyl)-1-phosphono-propyl]-methanoyl-amino]propanedioic acid Openeye Name: 2-[[1-(2-ethylphenyl)-1-phosphono-propyl]-formyl-amino]propanedioic acid CAS Name: 2-[[1-(2-ethylphenyl)-1-phosphonopropyl]-formylamino]propanedioic acid IUPAC Name: 2-[[1-(2-ethylphenyl)-1-phosphonopropyl]-formylamino]propanedioic acid Traditional Name: 2-[[1-(2-ethylphenyl)-1-phosphono-propyl]-formyl-amino]malonic acid Formula: C15H20NO8P MolecularWeight: 373.294961

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1C(CC)(N(C=O)C(C(=O)O)C(=O)O)P(=O)(O)O

Isomeric SMILES

CCC1=CC=CC=C1C(CC)(N(C=O)C(C(=O)O)C(=O)O)P(=O)(O)O

InChI

InChI=1S/C15H20NO8P/c1-3-10-7-5-6-8-11(10)15(4-2,25(22,23)24)16(9-17)12(13(18)19)14(20)21/h5-9,12H,3-4H2,1-2H3,(H,18,19)(H,20,21)(H2,22,23,24)