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

Systemtic Name: (3R)-3-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]pyrrolidine-2,5-dione Openeye Name: (3R)-3-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]pyrrolidine-2,5-dione CAS Name: (3R)-3-[4-(3,4-dichlorophenyl)-1-piperazin-1-iumyl]pyrrolidine-2,5-dione IUPAC Name: (3R)-3-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]pyrrolidine-2,5-dione Traditional Name: (3R)-3-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]pyrrolidine-2,5-quinone Formula: C14H16Cl2N3O2+ MolecularWeight: 329.20174

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C2CC(=O)NC2=O)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN(CC[NH+]1[C@@H]2CC(=O)NC2=O)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C14H15Cl2N3O2/c15-10-2-1-9(7-11(10)16)18-3-5-19(6-4-18)12-8-13(20)17-14(12)21/h1-2,7,12H,3-6,8H2,(H,17,20,21)/p+1/t12-/m1/s1