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

Systemtic Name: (3R)-1-(4-methoxyphenyl)-3-[4-(2-phenoxyethyl)piperazin-1-ium-1-yl]pyrrolidine-2,5-dione Openeye Name: (3R)-1-(4-methoxyphenyl)-3-[4-(2-phenoxyethyl)piperazin-1-ium-1-yl]pyrrolidine-2,5-dione CAS Name: (3R)-1-(4-methoxyphenyl)-3-[4-(2-phenoxyethyl)-1-piperazin-1-iumyl]pyrrolidine-2,5-dione IUPAC Name: (3R)-1-(4-methoxyphenyl)-3-[4-(2-phenoxyethyl)piperazin-1-ium-1-yl]pyrrolidine-2,5-dione Traditional Name: (3R)-1-(4-methoxyphenyl)-3-[4-(2-phenoxyethyl)piperazin-1-ium-1-yl]pyrrolidine-2,5-quinone Formula: C23H28N3O4+ MolecularWeight: 410.48612

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)CC(C2=O)[NH+]3CCN(CC3)CCOC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C[C@H](C2=O)[NH+]3CCN(CC3)CCOC4=CC=CC=C4

InChI

InChI=1S/C23H27N3O4/c1-29-19-9-7-18(8-10-19)26-22(27)17-21(23(26)28)25-13-11-24(12-14-25)15-16-30-20-5-3-2-4-6-20/h2-10,21H,11-17H2,1H3/p+1/t21-/m1/s1