[4-[2-(4-ethyl-4-methyl-piperazin-4-ium-1-yl)-2-oxidanylidene-ethoxy]phenyl] N,N-dimethylcarbamate iodide

Systemtic Name: [4-[2-(4-ethyl-4-methyl-piperazin-4-ium-1-yl)-2-oxidanylidene-ethoxy]phenyl] N,N-dimethylcarbamate iodide Openeye Name: [4-[2-(4-ethyl-4-methyl-piperazin-4-ium-1-yl)-2-oxo-ethoxy]phenyl] N,N-dimethylcarbamate iodide CAS Name: N,N-dimethylcarbamic acid [4-[2-(4-ethyl-4-methyl-1-piperazin-4-iumyl)-2-oxoethoxy]phenyl] ester iodide IUPAC Name: [4-[2-(4-ethyl-4-methylpiperazin-4-ium-1-yl)-2-oxoethoxy]phenyl] N,N-dimethylcarbamate iodide Traditional Name: N,N-dimethylcarbamic acid [4-[2-(4-ethyl-4-methyl-piperazin-4-ium-1-yl)-2-keto-ethoxy]phenyl] ester iodide Formula: C18H28IN3O4 MolecularWeight: 477.33709

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(CCN(CC1)C(=O)COC2=CC=C(C=C2)OC(=O)N(C)C)C.[I-]

Isomeric SMILES

CC[N+]1(CCN(CC1)C(=O)COC2=CC=C(C=C2)OC(=O)N(C)C)C.[I-]

InChI

InChI=1S/C18H28N3O4.HI/c1-5-21(4)12-10-20(11-13-21)17(22)14-24-15-6-8-16(9-7-15)25-18(23)19(2)3;/h6-9H,5,10-14H2,1-4H3;1H/q+1;/p-1