methyl 1-(3-bromanyl-4-methoxy-phenyl)sulfonylpyrrolidine-2-carboxylate

Systemtic Name: methyl 1-(3-bromanyl-4-methoxy-phenyl)sulfonylpyrrolidine-2-carboxylate Openeye Name: methyl 1-(3-bromo-4-methoxy-phenyl)sulfonylpyrrolidine-2-carboxylate CAS Name: 1-(3-bromo-4-methoxyphenyl)sulfonyl-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-bromo-4-methoxyphenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: 1-(3-bromo-4-methoxy-phenyl)sulfonylpyrrolidine-2-carboxylic acid methyl ester Formula: C13H16BrNO5S MolecularWeight: 378.23884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16BrNO5S/c1-19-12-6-5-9(8-10(12)14)21(17,18)15-7-3-4-11(15)13(16)20-2/h5-6,8,11H,3-4,7H2,1-2H3