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

Systemtic Name: (3S)-3-(4-methylpiperazine-1,4-diium-1-yl)-1-(4-piperidin-1-ylphenyl)pyrrolidine-2,5-dione Openeye Name: (3S)-3-(4-methylpiperazine-1,4-diium-1-yl)-1-[4-(1-piperidyl)phenyl]pyrrolidine-2,5-dione CAS Name: (3S)-3-(4-methyl-1-piperazine-1,4-diiumyl)-1-[4-(1-piperidinyl)phenyl]pyrrolidine-2,5-dione IUPAC Name: (3S)-3-(4-methylpiperazine-1,4-diium-1-yl)-1-(4-piperidin-1-ylphenyl)pyrrolidine-2,5-dione Traditional Name: (3S)-3-(4-methylpiperazine-1,4-diium-1-yl)-1-(4-piperidinophenyl)pyrrolidine-2,5-quinone Formula: C20H30N4O2+2 MolecularWeight: 358.4778

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)C2CC(=O)N(C2=O)C3=CC=C(C=C3)N4CCCCC4

Isomeric SMILES

C[NH+]1CC[NH+](CC1)[C@H]2CC(=O)N(C2=O)C3=CC=C(C=C3)N4CCCCC4

InChI

InChI=1S/C20H28N4O2/c1-21-11-13-23(14-12-21)18-15-19(25)24(20(18)26)17-7-5-16(6-8-17)22-9-3-2-4-10-22/h5-8,18H,2-4,9-15H2,1H3/p+2/t18-/m0/s1