2-(2,6-dimethylphenoxy)ethyl 4-chloranyl-3-methylsulfonyl-benzoate

Systemtic Name: 2-(2,6-dimethylphenoxy)ethyl 4-chloranyl-3-methylsulfonyl-benzoate Openeye Name: 2-(2,6-dimethylphenoxy)ethyl 4-chloro-3-methylsulfonyl-benzoate CAS Name: 4-chloro-3-methylsulfonylbenzoic acid 2-(2,6-dimethylphenoxy)ethyl ester IUPAC Name: 2-(2,6-dimethylphenoxy)ethyl 4-chloro-3-methylsulfonylbenzoate Traditional Name: 4-chloro-3-mesyl-benzoic acid 2-(2,6-dimethylphenoxy)ethyl ester Formula: C18H19ClO5S MolecularWeight: 382.85846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCOC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCOC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C18H19ClO5S/c1-12-5-4-6-13(2)17(12)23-9-10-24-18(20)14-7-8-15(19)16(11-14)25(3,21)22/h4-8,11H,9-10H2,1-3H3