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

Systemtic Name: methyl 2-bromanyl-4-(2-methylcyclopentyl)-3-methylsulfonyl-benzoate Openeye Name: methyl 2-bromo-4-(2-methylcyclopentyl)-3-methylsulfonyl-benzoate CAS Name: 2-bromo-4-(2-methylcyclopentyl)-3-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 2-bromo-4-(2-methylcyclopentyl)-3-methylsulfonylbenzoate Traditional Name: 2-bromo-3-mesyl-4-(2-methylcyclopentyl)benzoic acid methyl ester Formula: C15H19BrO4S MolecularWeight: 375.27796

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC1C2=C(C(=C(C=C2)C(=O)OC)Br)S(=O)(=O)C

Isomeric SMILES

CC1CCCC1C2=C(C(=C(C=C2)C(=O)OC)Br)S(=O)(=O)C

InChI

InChI=1S/C15H19BrO4S/c1-9-5-4-6-10(9)11-7-8-12(15(17)20-2)13(16)14(11)21(3,18)19/h7-10H,4-6H2,1-3H3