1-(3-bromanyl-4-methoxy-phenyl)sulfonyl-4-ethyl-piperazine hydrochloride

Systemtic Name: 1-(3-bromanyl-4-methoxy-phenyl)sulfonyl-4-ethyl-piperazine hydrochloride Openeye Name: 1-(3-bromo-4-methoxy-phenyl)sulfonyl-4-ethyl-piperazine hydrochloride CAS Name: 1-(3-bromo-4-methoxyphenyl)sulfonyl-4-ethylpiperazine hydrochloride IUPAC Name: 1-(3-bromo-4-methoxyphenyl)sulfonyl-4-ethylpiperazine hydrochloride Traditional Name: 1-(3-bromo-4-methoxy-phenyl)sulfonyl-4-ethyl-piperazine hydrochloride Formula: C13H20BrClN2O3S MolecularWeight: 399.7315

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)Br.Cl

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)Br.Cl

InChI

InChI=1S/C13H19BrN2O3S.ClH/c1-3-15-6-8-16(9-7-15)20(17,18)11-4-5-13(19-2)12(14)10-11;/h4-5,10H,3,6-9H2,1-2H3;1H