3-(4-chloranyl-3-methyl-phenoxy)-2,2-dimethyl-propanoate

Systemtic Name: 3-(4-chloranyl-3-methyl-phenoxy)-2,2-dimethyl-propanoate Openeye Name: 3-(4-chloro-3-methyl-phenoxy)-2,2-dimethyl-propanoate CAS Name: 3-(4-chloro-3-methylphenoxy)-2,2-dimethylpropanoate IUPAC Name: 3-(4-chloro-3-methylphenoxy)-2,2-dimethylpropanoate Traditional Name: 3-(4-chloro-3-methyl-phenoxy)-2,2-dimethyl-propionate Formula: C12H14ClO3- MolecularWeight: 241.69076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(C)(C)C(=O)[O-])Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(C)(C)C(=O)[O-])Cl

InChI

InChI=1S/C12H15ClO3/c1-8-6-9(4-5-10(8)13)16-7-12(2,3)11(14)15/h4-6H,7H2,1-3H3,(H,14,15)/p-1