(3R)-1-phenyl-3-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)pyrrolidine-2,5-dione

Systemtic Name: (3R)-1-phenyl-3-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)pyrrolidine-2,5-dione Openeye Name: (3R)-1-phenyl-3-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)pyrrolidine-2,5-dione CAS Name: (3R)-1-phenyl-3-[4-(1-piperidin-1-iumyl)-1-piperidin-1-iumyl]pyrrolidine-2,5-dione IUPAC Name: (3R)-1-phenyl-3-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)pyrrolidine-2,5-dione Traditional Name: (3R)-1-phenyl-3-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)pyrrolidine-2,5-quinone Formula: C20H29N3O2+2 MolecularWeight: 343.46316

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2CC[NH+](CC2)C3CC(=O)N(C3=O)C4=CC=CC=C4

Isomeric SMILES

C1CC[NH+](CC1)C2CC[NH+](CC2)[C@@H]3CC(=O)N(C3=O)C4=CC=CC=C4

InChI

InChI=1S/C20H27N3O2/c24-19-15-18(20(25)23(19)17-7-3-1-4-8-17)22-13-9-16(10-14-22)21-11-5-2-6-12-21/h1,3-4,7-8,16,18H,2,5-6,9-15H2/p+2/t18-/m1/s1