(3S)-1-(3-chlorophenyl)-3-(4-ethylpiperazine-1,4-diium-1-yl)pyrrolidine-2,5-dione

Systemtic Name: (3S)-1-(3-chlorophenyl)-3-(4-ethylpiperazine-1,4-diium-1-yl)pyrrolidine-2,5-dione Openeye Name: (3S)-1-(3-chlorophenyl)-3-(4-ethylpiperazine-1,4-diium-1-yl)pyrrolidine-2,5-dione CAS Name: (3S)-1-(3-chlorophenyl)-3-(4-ethyl-1-piperazine-1,4-diiumyl)pyrrolidine-2,5-dione IUPAC Name: (3S)-1-(3-chlorophenyl)-3-(4-ethylpiperazine-1,4-diium-1-yl)pyrrolidine-2,5-dione Traditional Name: (3S)-1-(3-chlorophenyl)-3-(4-ethylpiperazine-1,4-diium-1-yl)pyrrolidine-2,5-quinone Formula: C16H22ClN3O2+2 MolecularWeight: 323.81778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)C2CC(=O)N(C2=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)[C@H]2CC(=O)N(C2=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C16H20ClN3O2/c1-2-18-6-8-19(9-7-18)14-11-15(21)20(16(14)22)13-5-3-4-12(17)10-13/h3-5,10,14H,2,6-9,11H2,1H3/p+2/t14-/m0/s1