2-[4-[2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]ethanoyl]piperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-[2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]ethanoyl]piperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-[2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]acetyl]piperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[2-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]-1-oxoethyl]-1-piperazin-1-iumyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-[2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]acetyl]piperazin-1-ium-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-[2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]acetyl]piperazin-1-ium-1-yl]-1-pyrrolidino-ethanone Formula: C23H37N5O3+2 MolecularWeight: 431.57158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)N3CC[NH+](CC3)CC(=O)N4CCCC4

Isomeric SMILES

COC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)N3CC[NH+](CC3)CC(=O)N4CCCC4

InChI

InChI=1S/C23H35N5O3/c1-31-21-7-3-2-6-20(21)26-14-10-24(11-15-26)19-23(30)28-16-12-25(13-17-28)18-22(29)27-8-4-5-9-27/h2-3,6-7H,4-5,8-19H2,1H3/p+2