(3R)-1-phenethyl-3-(4-pyrazin-2-ylpiperazin-1-ium-1-yl)pyrrolidine-2,5-dione

Systemtic Name: (3R)-1-phenethyl-3-(4-pyrazin-2-ylpiperazin-1-ium-1-yl)pyrrolidine-2,5-dione Openeye Name: (3R)-1-phenethyl-3-(4-pyrazin-2-ylpiperazin-1-ium-1-yl)pyrrolidine-2,5-dione CAS Name: (3R)-1-phenethyl-3-[4-(2-pyrazinyl)-1-piperazin-1-iumyl]pyrrolidine-2,5-dione IUPAC Name: (3R)-1-phenethyl-3-(4-pyrazin-2-ylpiperazin-1-ium-1-yl)pyrrolidine-2,5-dione Traditional Name: (3R)-1-phenethyl-3-(4-pyrazin-2-ylpiperazin-1-ium-1-yl)pyrrolidine-2,5-quinone Formula: C20H24N5O2+ MolecularWeight: 366.43686

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C2CC(=O)N(C2=O)CCC3=CC=CC=C3)C4=NC=CN=C4

Isomeric SMILES

C1CN(CC[NH+]1[C@@H]2CC(=O)N(C2=O)CCC3=CC=CC=C3)C4=NC=CN=C4

InChI

InChI=1S/C20H23N5O2/c26-19-14-17(20(27)25(19)9-6-16-4-2-1-3-5-16)23-10-12-24(13-11-23)18-15-21-7-8-22-18/h1-5,7-8,15,17H,6,9-14H2/p+1/t17-/m1/s1