(3R)-1-(4-ethoxyphenyl)-3-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]pyrrolidine-2,5-dione

Systemtic Name: (3R)-1-(4-ethoxyphenyl)-3-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]pyrrolidine-2,5-dione Openeye Name: (3R)-3-(4-benzoylpiperazin-1-ium-1-yl)-1-(4-ethoxyphenyl)pyrrolidine-2,5-dione CAS Name: (3R)-3-(4-benzoyl-1-piperazin-1-iumyl)-1-(4-ethoxyphenyl)pyrrolidine-2,5-dione IUPAC Name: (3R)-3-(4-benzoylpiperazin-1-ium-1-yl)-1-(4-ethoxyphenyl)pyrrolidine-2,5-dione Traditional Name: (3R)-3-(4-benzoylpiperazin-1-ium-1-yl)-1-p-phenetyl-pyrrolidine-2,5-quinone Formula: C23H26N3O4+ MolecularWeight: 408.47024

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)[NH+]3CCN(CC3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C[C@H](C2=O)[NH+]3CCN(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3O4/c1-2-30-19-10-8-18(9-11-19)26-21(27)16-20(23(26)29)24-12-14-25(15-13-24)22(28)17-6-4-3-5-7-17/h3-11,20H,2,12-16H2,1H3/p+1/t20-/m1/s1