(3R)-1-(4-butoxyphenyl)-3-[4-(phenylmethyl)piperazin-1-yl]pyrrolidine-2,5-dione

Systemtic Name: (3R)-1-(4-butoxyphenyl)-3-[4-(phenylmethyl)piperazin-1-yl]pyrrolidine-2,5-dione Openeye Name: (3R)-3-(4-benzylpiperazin-1-yl)-1-(4-butoxyphenyl)pyrrolidine-2,5-dione CAS Name: (3R)-1-(4-butoxyphenyl)-3-[4-(phenylmethyl)-1-piperazinyl]pyrrolidine-2,5-dione IUPAC Name: (3R)-3-(4-benzylpiperazin-1-yl)-1-(4-butoxyphenyl)pyrrolidine-2,5-dione Traditional Name: (3R)-3-(4-benzylpiperazino)-1-(4-butoxyphenyl)pyrrolidine-2,5-quinone Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCCCOC1=CC=C(C=C1)N2C(=O)C[C@H](C2=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H31N3O3/c1-2-3-17-31-22-11-9-21(10-12-22)28-24(29)18-23(25(28)30)27-15-13-26(14-16-27)19-20-7-5-4-6-8-20/h4-12,23H,2-3,13-19H2,1H3/t23-/m1/s1