[2-[4-(3-bromanyl-5-chloranyl-2-methoxy-phenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-dimethyl-azanium

Systemtic Name: [2-[4-(3-bromanyl-5-chloranyl-2-methoxy-phenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-dimethyl-azanium Openeye Name: [2-[4-(3-bromo-5-chloro-2-methoxy-phenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]-dimethyl-ammonium CAS Name: [2-[4-(3-bromo-5-chloro-2-methoxyphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-dimethylammonium IUPAC Name: [2-[4-(3-bromo-5-chloro-2-methoxyphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]-dimethylazanium Traditional Name: [2-[4-(3-bromo-5-chloro-2-methoxy-phenyl)sulfonylpiperazino]-2-keto-ethyl]-dimethyl-ammonium Formula: C15H22BrClN3O4S+ MolecularWeight: 455.77488

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=CC(=C2OC)Br)Cl

Isomeric SMILES

C[NH+](C)CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=CC(=C2OC)Br)Cl

InChI

InChI=1S/C15H21BrClN3O4S/c1-18(2)10-14(21)19-4-6-20(7-5-19)25(22,23)13-9-11(17)8-12(16)15(13)24-3/h8-9H,4-7,10H2,1-3H3/p+1