(3R)-3-phenyl-1-[[4-(phenylsulfonyl)piperazin-1-ium-1-yl]methyl]pyrrolidine-2,5-dione

Systemtic Name: (3R)-3-phenyl-1-[[4-(phenylsulfonyl)piperazin-1-ium-1-yl]methyl]pyrrolidine-2,5-dione Openeye Name: (3R)-1-[[4-(benzenesulfonyl)piperazin-1-ium-1-yl]methyl]-3-phenyl-pyrrolidine-2,5-dione CAS Name: (3R)-1-[[4-(benzenesulfonyl)-1-piperazin-1-iumyl]methyl]-3-phenylpyrrolidine-2,5-dione IUPAC Name: (3R)-1-[[4-(benzenesulfonyl)piperazin-1-ium-1-yl]methyl]-3-phenylpyrrolidine-2,5-dione Traditional Name: (3R)-1-[(4-besylpiperazin-1-ium-1-yl)methyl]-3-phenyl-pyrrolidine-2,5-quinone Formula: C21H24N3O4S+ MolecularWeight: 414.49796

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CN2C(=O)CC(C2=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CN2C(=O)C[C@@H](C2=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H23N3O4S/c25-20-15-19(17-7-3-1-4-8-17)21(26)24(20)16-22-11-13-23(14-12-22)29(27,28)18-9-5-2-6-10-18/h1-10,19H,11-16H2/p+1/t19-/m1/s1