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

Systemtic Name: 2-[[(3-methylphenyl)methyl-oxidanyl-phosphoryl]amino]pentanedioic acid Openeye Name: 2-[[hydroxy(m-tolylmethyl)phosphoryl]amino]pentanedioic acid CAS Name: 2-[[hydroxy-[(3-methylphenyl)methyl]phosphoryl]amino]pentanedioic acid IUPAC Name: 2-[[hydroxy-[(3-methylphenyl)methyl]phosphoryl]amino]pentanedioic acid Traditional Name: 2-[[hydroxy-(3-methylbenzyl)phosphoryl]amino]glutaric acid Formula: C13H18NO6P MolecularWeight: 315.258881

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CP(=O)(NC(CCC(=O)O)C(=O)O)O

Isomeric SMILES

CC1=CC(=CC=C1)CP(=O)(NC(CCC(=O)O)C(=O)O)O

InChI

InChI=1S/C13H18NO6P/c1-9-3-2-4-10(7-9)8-21(19,20)14-11(13(17)18)5-6-12(15)16/h2-4,7,11H,5-6,8H2,1H3,(H,15,16)(H,17,18)(H2,14,19,20)