2-[[[(3-chlorophenyl)amino]methyl-oxidanyl-phosphoryl]methyl]pentanedioic acid

Systemtic Name: 2-[[[(3-chlorophenyl)amino]methyl-oxidanyl-phosphoryl]methyl]pentanedioic acid Openeye Name: 2-[[(3-chloroanilino)methyl-hydroxy-phosphoryl]methyl]pentanedioic acid CAS Name: 2-[[(3-chloroanilino)methyl-hydroxyphosphoryl]methyl]pentanedioic acid IUPAC Name: 2-[[(3-chloroanilino)methyl-hydroxyphosphoryl]methyl]pentanedioic acid Traditional Name: 2-[[(3-chloroanilino)methyl-hydroxy-phosphoryl]methyl]glutaric acid Formula: C13H17ClNO6P MolecularWeight: 349.703941

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NCP(=O)(CC(CCC(=O)O)C(=O)O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NCP(=O)(CC(CCC(=O)O)C(=O)O)O

InChI

InChI=1S/C13H17ClNO6P/c14-10-2-1-3-11(6-10)15-8-22(20,21)7-9(13(18)19)4-5-12(16)17/h1-3,6,9,15H,4-5,7-8H2,(H,16,17)(H,18,19)(H,20,21)