methyl 5-methylsulfonyl-2,4-dipropyl-benzoate

Systemtic Name: methyl 5-methylsulfonyl-2,4-dipropyl-benzoate Openeye Name: methyl 5-methylsulfonyl-2,4-dipropyl-benzoate CAS Name: 5-methylsulfonyl-2,4-dipropylbenzoic acid methyl ester IUPAC Name: methyl 5-methylsulfonyl-2,4-dipropylbenzoate Traditional Name: 5-mesyl-2,4-dipropyl-benzoic acid methyl ester Formula: C15H22O4S MolecularWeight: 298.39778

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1C(=O)OC)S(=O)(=O)C)CCC

Isomeric SMILES

CCCC1=CC(=C(C=C1C(=O)OC)S(=O)(=O)C)CCC

InChI

InChI=1S/C15H22O4S/c1-5-7-11-9-12(8-6-2)14(20(4,17)18)10-13(11)15(16)19-3/h9-10H,5-8H2,1-4H3