2-[[bis(chloranyl)-phosphono-methyl]-phenylmethoxycarbonyl-amino]butanoic acid

Systemtic Name: 2-[[bis(chloranyl)-phosphono-methyl]-phenylmethoxycarbonyl-amino]butanoic acid Openeye Name: 2-[benzyloxycarbonyl-[dichloro(phosphono)methyl]amino]butanoic acid CAS Name: 2-[[dichloro(phosphono)methyl]-phenylmethoxycarbonylamino]butanoic acid IUPAC Name: 2-[[dichloro(phosphono)methyl]-phenylmethoxycarbonylamino]butanoic acid Traditional Name: 2-[carbobenzoxy-[dichloro(phosphono)methyl]amino]butyric acid Formula: C13H16Cl2NO7P MolecularWeight: 400.148401

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)N(C(=O)OCC1=CC=CC=C1)C(P(=O)(O)O)(Cl)Cl

Isomeric SMILES

CCC(C(=O)O)N(C(=O)OCC1=CC=CC=C1)C(P(=O)(O)O)(Cl)Cl

InChI

InChI=1S/C13H16Cl2NO7P/c1-2-10(11(17)18)16(13(14,15)24(20,21)22)12(19)23-8-9-6-4-3-5-7-9/h3-7,10H,2,8H2,1H3,(H,17,18)(H2,20,21,22)