1-(5-bromanyl-2-methoxy-phenyl)sulfonylpyrrolidine-2-carboxylic acid

Systemtic Name: 1-(5-bromanyl-2-methoxy-phenyl)sulfonylpyrrolidine-2-carboxylic acid Openeye Name: 1-(5-bromo-2-methoxy-phenyl)sulfonylpyrrolidine-2-carboxylic acid CAS Name: 1-(5-bromo-2-methoxyphenyl)sulfonyl-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(5-bromo-2-methoxyphenyl)sulfonylpyrrolidine-2-carboxylic acid Traditional Name: 1-(5-bromo-2-methoxy-phenyl)sulfonylproline Formula: C12H14BrNO5S MolecularWeight: 364.21226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14BrNO5S/c1-19-10-5-4-8(13)7-11(10)20(17,18)14-6-2-3-9(14)12(15)16/h4-5,7,9H,2-3,6H2,1H3,(H,15,16)