methyl 4-butoxy-2-ethyl-5-methylsulfonyl-benzoate

Systemtic Name: methyl 4-butoxy-2-ethyl-5-methylsulfonyl-benzoate Openeye Name: methyl 4-butoxy-2-ethyl-5-methylsulfonyl-benzoate CAS Name: 4-butoxy-2-ethyl-5-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 4-butoxy-2-ethyl-5-methylsulfonylbenzoate Traditional Name: 4-butoxy-2-ethyl-5-mesyl-benzoic acid methyl ester Formula: C15H22O5S MolecularWeight: 314.39718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C(=C1)CC)C(=O)OC)S(=O)(=O)C

Isomeric SMILES

CCCCOC1=C(C=C(C(=C1)CC)C(=O)OC)S(=O)(=O)C

InChI

InChI=1S/C15H22O5S/c1-5-7-8-20-13-9-11(6-2)12(15(16)19-3)10-14(13)21(4,17)18/h9-10H,5-8H2,1-4H3