1-(4-bromanyl-3-methyl-phenyl)sulfonylpyrrolidine-2-carboxylic acid

Systemtic Name: 1-(4-bromanyl-3-methyl-phenyl)sulfonylpyrrolidine-2-carboxylic acid Openeye Name: 1-(4-bromo-3-methyl-phenyl)sulfonylpyrrolidine-2-carboxylic acid CAS Name: 1-(4-bromo-3-methylphenyl)sulfonyl-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(4-bromo-3-methylphenyl)sulfonylpyrrolidine-2-carboxylic acid Traditional Name: 1-(4-bromo-3-methyl-phenyl)sulfonylproline Formula: C12H14BrNO4S MolecularWeight: 348.21286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CCCC2C(=O)O)Br

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CCCC2C(=O)O)Br

InChI

InChI=1S/C12H14BrNO4S/c1-8-7-9(4-5-10(8)13)19(17,18)14-6-2-3-11(14)12(15)16/h4-5,7,11H,2-3,6H2,1H3,(H,15,16)