2-[4-[2,5-bis(bromanyl)phenyl]sulfonylpiperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[2,5-bis(bromanyl)phenyl]sulfonylpiperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(2,5-dibromophenyl)sulfonylpiperazin-1-yl]acetic acid CAS Name: 2-[4-(2,5-dibromophenyl)sulfonyl-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(2,5-dibromophenyl)sulfonylpiperazin-1-yl]acetic acid Traditional Name: 2-[4-(2,5-dibromophenyl)sulfonylpiperazino]acetic acid Formula: C12H14Br2N2O4S MolecularWeight: 442.12356

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)O)S(=O)(=O)C2=C(C=CC(=C2)Br)Br

Isomeric SMILES

C1CN(CCN1CC(=O)O)S(=O)(=O)C2=C(C=CC(=C2)Br)Br

InChI

InChI=1S/C12H14Br2N2O4S/c13-9-1-2-10(14)11(7-9)21(19,20)16-5-3-15(4-6-16)8-12(17)18/h1-2,7H,3-6,8H2,(H,17,18)