3-(3-chlorophenyl)sulfanyl-2,2-dimethyl-propanoate

Systemtic Name: 3-(3-chlorophenyl)sulfanyl-2,2-dimethyl-propanoate Openeye Name: 3-(3-chlorophenyl)sulfanyl-2,2-dimethyl-propanoate CAS Name: 3-[(3-chlorophenyl)thio]-2,2-dimethylpropanoate IUPAC Name: 3-(3-chlorophenyl)sulfanyl-2,2-dimethylpropanoate Traditional Name: 3-[(3-chlorophenyl)thio]-2,2-dimethyl-propionate Formula: C11H12ClO2S- MolecularWeight: 243.72978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CSC1=CC(=CC=C1)Cl)C(=O)[O-]

Isomeric SMILES

CC(C)(CSC1=CC(=CC=C1)Cl)C(=O)[O-]

InChI

InChI=1S/C11H13ClO2S/c1-11(2,10(13)14)7-15-9-5-3-4-8(12)6-9/h3-6H,7H2,1-2H3,(H,13,14)/p-1