2-[2-(4-chloranyl-2-methyl-phenoxy)ethanoylamino]pentanedioic acid

Systemtic Name: 2-[2-(4-chloranyl-2-methyl-phenoxy)ethanoylamino]pentanedioic acid Openeye Name: 2-[[2-(4-chloro-2-methyl-phenoxy)acetyl]amino]pentanedioic acid CAS Name: 2-[[2-(4-chloro-2-methylphenoxy)-1-oxoethyl]amino]pentanedioic acid IUPAC Name: 2-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]pentanedioic acid Traditional Name: 2-[[2-(4-chloro-2-methyl-phenoxy)acetyl]amino]glutaric acid Formula: C14H16ClNO6 MolecularWeight: 329.73294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCC(=O)NC(CCC(=O)O)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCC(=O)NC(CCC(=O)O)C(=O)O

InChI

InChI=1S/C14H16ClNO6/c1-8-6-9(15)2-4-11(8)22-7-12(17)16-10(14(20)21)3-5-13(18)19/h2,4,6,10H,3,5,7H2,1H3,(H,16,17)(H,18,19)(H,20,21)