methyl 2-chloranyl-4-methylsulfonyl-3-phenyl-benzoate

Systemtic Name: methyl 2-chloranyl-4-methylsulfonyl-3-phenyl-benzoate Openeye Name: methyl 2-chloro-4-methylsulfonyl-3-phenyl-benzoate CAS Name: 2-chloro-4-methylsulfonyl-3-phenylbenzoic acid methyl ester IUPAC Name: methyl 2-chloro-4-methylsulfonyl-3-phenylbenzoate Traditional Name: 2-chloro-4-mesyl-3-phenyl-benzoic acid methyl ester Formula: C15H13ClO4S MolecularWeight: 324.77932

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=C(C=C1)S(=O)(=O)C)C2=CC=CC=C2)Cl

Isomeric SMILES

COC(=O)C1=C(C(=C(C=C1)S(=O)(=O)C)C2=CC=CC=C2)Cl

InChI

InChI=1S/C15H13ClO4S/c1-20-15(17)11-8-9-12(21(2,18)19)13(14(11)16)10-6-4-3-5-7-10/h3-9H,1-2H3