1-[4-(6-bromanylnaphthalen-2-yl)sulfonylphenyl]-2-sulfonyl-piperazine hydrochloride

Systemtic Name: 1-[4-(6-bromanylnaphthalen-2-yl)sulfonylphenyl]-2-sulfonyl-piperazine hydrochloride Openeye Name: 1-[4-[(6-bromo-2-naphthyl)sulfonyl]phenyl]-2-sulfonyl-piperazine hydrochloride CAS Name: 1-[4-[(6-bromo-2-naphthalenyl)sulfonyl]phenyl]-2-sulfonylpiperazine hydrochloride IUPAC Name: 1-[4-(6-bromonaphthalen-2-yl)sulfonylphenyl]-2-sulfonylpiperazine hydrochloride Traditional Name: 1-[4-[(6-bromo-2-naphthyl)sulfonyl]phenyl]-2-sulfonyl-piperazine hydrochloride Formula: C20H18BrClN2O4S2 MolecularWeight: 529.85492

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=S(=O)=O)CN1)C2=CC=C(C=C2)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Br.Cl

Isomeric SMILES

C1CN(C(=S(=O)=O)CN1)C2=CC=C(C=C2)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Br.Cl

InChI

InChI=1S/C20H17BrN2O4S2.ClH/c21-16-3-1-15-12-19(6-2-14(15)11-16)29(26,27)18-7-4-17(5-8-18)23-10-9-22-13-20(23)28(24)25;/h1-8,11-12,22H,9-10,13H2;1H