methyl 2-ethyl-4-(2-methylcyclopentyl)-3-methylsulfonyl-benzoate

Systemtic Name: methyl 2-ethyl-4-(2-methylcyclopentyl)-3-methylsulfonyl-benzoate Openeye Name: methyl 2-ethyl-4-(2-methylcyclopentyl)-3-methylsulfonyl-benzoate CAS Name: 2-ethyl-4-(2-methylcyclopentyl)-3-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 2-ethyl-4-(2-methylcyclopentyl)-3-methylsulfonylbenzoate Traditional Name: 2-ethyl-3-mesyl-4-(2-methylcyclopentyl)benzoic acid methyl ester Formula: C17H24O4S MolecularWeight: 324.43506

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1S(=O)(=O)C)C2CCCC2C)C(=O)OC

Isomeric SMILES

CCC1=C(C=CC(=C1S(=O)(=O)C)C2CCCC2C)C(=O)OC

InChI

InChI=1S/C17H24O4S/c1-5-12-15(17(18)21-3)10-9-14(16(12)22(4,19)20)13-8-6-7-11(13)2/h9-11,13H,5-8H2,1-4H3