(3R)-1-(5-chloranyl-2-methoxy-phenyl)-3-(4-methylpiperazine-1,4-diium-1-yl)pyrrolidine-2,5-dione

Systemtic Name: (3R)-1-(5-chloranyl-2-methoxy-phenyl)-3-(4-methylpiperazine-1,4-diium-1-yl)pyrrolidine-2,5-dione Openeye Name: (3R)-1-(5-chloro-2-methoxy-phenyl)-3-(4-methylpiperazine-1,4-diium-1-yl)pyrrolidine-2,5-dione CAS Name: (3R)-1-(5-chloro-2-methoxyphenyl)-3-(4-methyl-1-piperazine-1,4-diiumyl)pyrrolidine-2,5-dione IUPAC Name: (3R)-1-(5-chloro-2-methoxyphenyl)-3-(4-methylpiperazine-1,4-diium-1-yl)pyrrolidine-2,5-dione Traditional Name: (3R)-1-(5-chloro-2-methoxy-phenyl)-3-(4-methylpiperazine-1,4-diium-1-yl)pyrrolidine-2,5-quinone Formula: C16H22ClN3O3+2 MolecularWeight: 339.81718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20ClN3O3/c1-18-5-7-19(8-6-18)13-10-15(21)20(16(13)22)12-9-11(17)3-4-14(12)23-2/h3-4,9,13H,5-8,10H2,1-2H3/p+2/t13-/m1/s1