1-(3-bromanyl-5-chloranyl-2-methoxy-phenyl)sulfonylpyrrolidine-2-carboxylic acid

Systemtic Name: 1-(3-bromanyl-5-chloranyl-2-methoxy-phenyl)sulfonylpyrrolidine-2-carboxylic acid Openeye Name: 1-(3-bromo-5-chloro-2-methoxy-phenyl)sulfonylpyrrolidine-2-carboxylic acid CAS Name: 1-(3-bromo-5-chloro-2-methoxyphenyl)sulfonyl-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(3-bromo-5-chloro-2-methoxyphenyl)sulfonylpyrrolidine-2-carboxylic acid Traditional Name: 1-(3-bromo-5-chloro-2-methoxy-phenyl)sulfonylproline Formula: C12H13BrClNO5S MolecularWeight: 398.65732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1S(=O)(=O)N2CCCC2C(=O)O)Cl)Br

Isomeric SMILES

COC1=C(C=C(C=C1S(=O)(=O)N2CCCC2C(=O)O)Cl)Br

InChI

InChI=1S/C12H13BrClNO5S/c1-20-11-8(13)5-7(14)6-10(11)21(18,19)15-4-2-3-9(15)12(16)17/h5-6,9H,2-4H2,1H3,(H,16,17)