(3S)-3-piperidin-1-ium-1-yl-1-(4-piperidin-1-ylphenyl)pyrrolidine-2,5-dione

Systemtic Name: (3S)-3-piperidin-1-ium-1-yl-1-(4-piperidin-1-ylphenyl)pyrrolidine-2,5-dione Openeye Name: (3S)-3-piperidin-1-ium-1-yl-1-[4-(1-piperidyl)phenyl]pyrrolidine-2,5-dione CAS Name: (3S)-3-(1-piperidin-1-iumyl)-1-[4-(1-piperidinyl)phenyl]pyrrolidine-2,5-dione IUPAC Name: (3S)-3-piperidin-1-ium-1-yl-1-(4-piperidin-1-ylphenyl)pyrrolidine-2,5-dione Traditional Name: (3S)-3-piperidin-1-ium-1-yl-1-(4-piperidinophenyl)pyrrolidine-2,5-quinone Formula: C20H28N3O2+ MolecularWeight: 342.45522

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2CC(=O)N(C2=O)C3=CC=C(C=C3)N4CCCCC4

Isomeric SMILES

C1CC[NH+](CC1)[C@H]2CC(=O)N(C2=O)C3=CC=C(C=C3)N4CCCCC4

InChI

InChI=1S/C20H27N3O2/c24-19-15-18(22-13-5-2-6-14-22)20(25)23(19)17-9-7-16(8-10-17)21-11-3-1-4-12-21/h7-10,18H,1-6,11-15H2/p+1/t18-/m0/s1