(3R)-3-(4-ethylpiperazin-1-ium-1-yl)-1-(4-hexoxyphenyl)pyrrolidine-2,5-dione

Systemtic Name: (3R)-3-(4-ethylpiperazin-1-ium-1-yl)-1-(4-hexoxyphenyl)pyrrolidine-2,5-dione Openeye Name: (3R)-3-(4-ethylpiperazin-1-ium-1-yl)-1-(4-hexoxyphenyl)pyrrolidine-2,5-dione CAS Name: (3R)-3-(4-ethyl-1-piperazin-1-iumyl)-1-(4-hexoxyphenyl)pyrrolidine-2,5-dione IUPAC Name: (3R)-3-(4-ethylpiperazin-1-ium-1-yl)-1-(4-hexoxyphenyl)pyrrolidine-2,5-dione Traditional Name: (3R)-3-(4-ethylpiperazin-1-ium-1-yl)-1-(4-hexoxyphenyl)pyrrolidine-2,5-quinone Formula: C22H34N3O3+ MolecularWeight: 388.52366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)[NH+]3CCN(CC3)CC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)N2C(=O)C[C@H](C2=O)[NH+]3CCN(CC3)CC

InChI

InChI=1S/C22H33N3O3/c1-3-5-6-7-16-28-19-10-8-18(9-11-19)25-21(26)17-20(22(25)27)24-14-12-23(4-2)13-15-24/h8-11,20H,3-7,12-17H2,1-2H3/p+1/t20-/m1/s1