(3R)-3-[4-(4-bromanyl-3-methyl-phenyl)sulfonylpiperazin-1-ium-1-yl]-1-naphthalen-1-yl-pyrrolidine-2,5-dione

Systemtic Name: (3R)-3-[4-(4-bromanyl-3-methyl-phenyl)sulfonylpiperazin-1-ium-1-yl]-1-naphthalen-1-yl-pyrrolidine-2,5-dione Openeye Name: (3R)-3-[4-(4-bromo-3-methyl-phenyl)sulfonylpiperazin-1-ium-1-yl]-1-(1-naphthyl)pyrrolidine-2,5-dione CAS Name: (3R)-3-[4-(4-bromo-3-methylphenyl)sulfonyl-1-piperazin-1-iumyl]-1-(1-naphthalenyl)pyrrolidine-2,5-dione IUPAC Name: (3R)-3-[4-(4-bromo-3-methylphenyl)sulfonylpiperazin-1-ium-1-yl]-1-naphthalen-1-ylpyrrolidine-2,5-dione Traditional Name: (3R)-3-[4-(4-bromo-3-methyl-phenyl)sulfonylpiperazin-1-ium-1-yl]-1-(1-naphthyl)pyrrolidine-2,5-quinone Formula: C25H25BrN3O4S+ MolecularWeight: 543.4527

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CC[NH+](CC2)C3CC(=O)N(C3=O)C4=CC=CC5=CC=CC=C54)Br

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CC[NH+](CC2)[C@@H]3CC(=O)N(C3=O)C4=CC=CC5=CC=CC=C54)Br

InChI

InChI=1S/C25H24BrN3O4S/c1-17-15-19(9-10-21(17)26)34(32,33)28-13-11-27(12-14-28)23-16-24(30)29(25(23)31)22-8-4-6-18-5-2-3-7-20(18)22/h2-10,15,23H,11-14,16H2,1H3/p+1/t23-/m1/s1