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

Systemtic Name: methyl 4-cyclopentyl-2-ethyl-5-methylsulfonyl-benzoate Openeye Name: methyl 4-cyclopentyl-2-ethyl-5-methylsulfonyl-benzoate CAS Name: 4-cyclopentyl-2-ethyl-5-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 4-cyclopentyl-2-ethyl-5-methylsulfonylbenzoate Traditional Name: 4-cyclopentyl-2-ethyl-5-mesyl-benzoic acid methyl ester Formula: C16H22O4S MolecularWeight: 310.40848

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1C(=O)OC)S(=O)(=O)C)C2CCCC2

Isomeric SMILES

CCC1=CC(=C(C=C1C(=O)OC)S(=O)(=O)C)C2CCCC2

InChI

InChI=1S/C16H22O4S/c1-4-11-9-13(12-7-5-6-8-12)15(21(3,18)19)10-14(11)16(17)20-2/h9-10,12H,4-8H2,1-3H3