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

Systemtic Name: (3R)-1-(4-methylphenyl)-3-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)pyrrolidine-2,5-dione Openeye Name: (3R)-3-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)-1-(p-tolyl)pyrrolidine-2,5-dione CAS Name: (3R)-1-(4-methylphenyl)-3-[4-(1-piperidin-1-iumyl)-1-piperidin-1-iumyl]pyrrolidine-2,5-dione IUPAC Name: (3R)-1-(4-methylphenyl)-3-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)pyrrolidine-2,5-dione Traditional Name: (3R)-3-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)-1-(p-tolyl)pyrrolidine-2,5-quinone Formula: C21H31N3O2+2 MolecularWeight: 357.48974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)CC(C2=O)[NH+]3CCC(CC3)[NH+]4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C[C@H](C2=O)[NH+]3CCC(CC3)[NH+]4CCCCC4

InChI

InChI=1S/C21H29N3O2/c1-16-5-7-18(8-6-16)24-20(25)15-19(21(24)26)23-13-9-17(10-14-23)22-11-3-2-4-12-22/h5-8,17,19H,2-4,9-15H2,1H3/p+2/t19-/m1/s1