(3R)-1-(2-butoxyphenyl)-3-(4-methylpiperazin-1-ium-1-yl)pyrrolidine-2,5-dione

Systemtic Name: (3R)-1-(2-butoxyphenyl)-3-(4-methylpiperazin-1-ium-1-yl)pyrrolidine-2,5-dione Openeye Name: (3R)-1-(2-butoxyphenyl)-3-(4-methylpiperazin-1-ium-1-yl)pyrrolidine-2,5-dione CAS Name: (3R)-1-(2-butoxyphenyl)-3-(4-methyl-1-piperazin-1-iumyl)pyrrolidine-2,5-dione IUPAC Name: (3R)-1-(2-butoxyphenyl)-3-(4-methylpiperazin-1-ium-1-yl)pyrrolidine-2,5-dione Traditional Name: (3R)-1-(2-butoxyphenyl)-3-(4-methylpiperazin-1-ium-1-yl)pyrrolidine-2,5-quinone Formula: C19H28N3O3+ MolecularWeight: 346.44392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1N2C(=O)CC(C2=O)[NH+]3CCN(CC3)C

Isomeric SMILES

CCCCOC1=CC=CC=C1N2C(=O)C[C@H](C2=O)[NH+]3CCN(CC3)C

InChI

InChI=1S/C19H27N3O3/c1-3-4-13-25-17-8-6-5-7-15(17)22-18(23)14-16(19(22)24)21-11-9-20(2)10-12-21/h5-8,16H,3-4,9-14H2,1-2H3/p+1/t16-/m1/s1