2-[4-(4-bromanyl-2-chloranyl-phenyl)sulfonylpiperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-(4-bromanyl-2-chloranyl-phenyl)sulfonylpiperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(4-bromo-2-chloro-phenyl)sulfonylpiperazin-1-yl]acetic acid CAS Name: 2-[4-(4-bromo-2-chlorophenyl)sulfonyl-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(4-bromo-2-chlorophenyl)sulfonylpiperazin-1-yl]acetic acid Traditional Name: 2-[4-(4-bromo-2-chloro-phenyl)sulfonylpiperazino]acetic acid Formula: C12H14BrClN2O4S MolecularWeight: 397.67256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14BrClN2O4S/c13-9-1-2-11(10(14)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)