methyl 1-[3-(bromomethyl)-2,4-dimethoxy-phenyl]sulfonylpyrrolidine-2-carboxylate

Systemtic Name: methyl 1-[3-(bromomethyl)-2,4-dimethoxy-phenyl]sulfonylpyrrolidine-2-carboxylate Openeye Name: methyl 1-[3-(bromomethyl)-2,4-dimethoxy-phenyl]sulfonylpyrrolidine-2-carboxylate CAS Name: 1-[3-(bromomethyl)-2,4-dimethoxyphenyl]sulfonyl-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[3-(bromomethyl)-2,4-dimethoxyphenyl]sulfonylpyrrolidine-2-carboxylate Traditional Name: 1-[3-(bromomethyl)-2,4-dimethoxy-phenyl]sulfonylpyrrolidine-2-carboxylic acid methyl ester Formula: C15H20BrNO6S MolecularWeight: 422.2914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)S(=O)(=O)N2CCCC2C(=O)OC)OC)CBr

Isomeric SMILES

COC1=C(C(=C(C=C1)S(=O)(=O)N2CCCC2C(=O)OC)OC)CBr

InChI

InChI=1S/C15H20BrNO6S/c1-21-12-6-7-13(14(22-2)10(12)9-16)24(19,20)17-8-4-5-11(17)15(18)23-3/h6-7,11H,4-5,8-9H2,1-3H3