sodium 2-(4-chloranyl-2-methyl-phenoxy)ethanoic acid

Systemtic Name: sodium 2-(4-chloranyl-2-methyl-phenoxy)ethanoic acid Openeye Name: sodium 2-(4-chloro-2-methyl-phenoxy)acetic acid CAS Name: sodium 2-(4-chloro-2-methylphenoxy)acetic acid IUPAC Name: sodium 2-(4-chloro-2-methylphenoxy)acetic acid Traditional Name: sodium 2-(4-chloro-2-methyl-phenoxy)acetic acid Formula: C9H9ClNaO3+ MolecularWeight: 223.60873

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCC(=O)O.[Na+]

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCC(=O)O.[Na+]

InChI

InChI=1S/C9H9ClO3.Na/c1-6-4-7(10)2-3-8(6)13-5-9(11)12;/h2-4H,5H2,1H3,(H,11,12);/q;+1