3-[4-(4-bromanyl-2-chloranyl-phenyl)sulfonylpiperazin-1-yl]butanoic acid

Systemtic Name: 3-[4-(4-bromanyl-2-chloranyl-phenyl)sulfonylpiperazin-1-yl]butanoic acid Openeye Name: 3-[4-(4-bromo-2-chloro-phenyl)sulfonylpiperazin-1-yl]butanoic acid CAS Name: 3-[4-(4-bromo-2-chlorophenyl)sulfonyl-1-piperazinyl]butanoic acid IUPAC Name: 3-[4-(4-bromo-2-chlorophenyl)sulfonylpiperazin-1-yl]butanoic acid Traditional Name: 3-[4-(4-bromo-2-chloro-phenyl)sulfonylpiperazino]butyric acid Formula: C14H18BrClN2O4S MolecularWeight: 425.72572

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)N1CCN(CC1)S(=O)(=O)C2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

CC(CC(=O)O)N1CCN(CC1)S(=O)(=O)C2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C14H18BrClN2O4S/c1-10(8-14(19)20)17-4-6-18(7-5-17)23(21,22)13-3-2-11(15)9-12(13)16/h2-3,9-10H,4-8H2,1H3,(H,19,20)