1-[4-(6-bromanylnaphthalen-2-yl)sulfonylphenyl]sulfonyl-1-pyridin-4-yl-piperazin-1-ium

Systemtic Name: 1-[4-(6-bromanylnaphthalen-2-yl)sulfonylphenyl]sulfonyl-1-pyridin-4-yl-piperazin-1-ium Openeye Name: 1-[4-[(6-bromo-2-naphthyl)sulfonyl]phenyl]sulfonyl-1-(4-pyridyl)piperazin-1-ium CAS Name: 1-[4-[(6-bromo-2-naphthalenyl)sulfonyl]phenyl]sulfonyl-1-pyridin-4-ylpiperazin-1-ium IUPAC Name: 1-[4-(6-bromonaphthalen-2-yl)sulfonylphenyl]sulfonyl-1-pyridin-4-ylpiperazin-1-ium Traditional Name: 1-[4-[(6-bromo-2-naphthyl)sulfonyl]phenyl]sulfonyl-1-(4-pyridyl)piperazin-1-ium Formula: C25H23BrN3O4S2+ MolecularWeight: 573.50182

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CCN1)(C2=CC=NC=C2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Br

Isomeric SMILES

C1C[N+](CCN1)(C2=CC=NC=C2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Br

InChI

InChI=1S/C25H23BrN3O4S2/c26-21-3-1-20-18-25(4-2-19(20)17-21)34(30,31)23-5-7-24(8-6-23)35(32,33)29(15-13-28-14-16-29)22-9-11-27-12-10-22/h1-12,17-18,28H,13-16H2/q+1