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

Systemtic Name: 1-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]pyrrolidine-2,5-dione Openeye Name: 1-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]pyrrolidine-2,5-dione CAS Name: 1-[[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]methyl]pyrrolidine-2,5-dione IUPAC Name: 1-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]pyrrolidine-2,5-dione Traditional Name: 1-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]pyrrolidine-2,5-quinone Formula: C16H22N3O3+ MolecularWeight: 304.36418

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC[NH+](CC2)CN3C(=O)CCC3=O

Isomeric SMILES

COC1=CC=C(C=C1)N2CC[NH+](CC2)CN3C(=O)CCC3=O

InChI

InChI=1S/C16H21N3O3/c1-22-14-4-2-13(3-5-14)18-10-8-17(9-11-18)12-19-15(20)6-7-16(19)21/h2-5H,6-12H2,1H3/p+1