2-(3-piperazin-4-ium-1-ylphenoxy)-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-(3-piperazin-4-ium-1-ylphenoxy)-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-(3-piperazin-4-ium-1-ylphenoxy)-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[3-(1-piperazin-4-iumyl)phenoxy]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-(3-piperazin-4-ium-1-ylphenoxy)-1-pyrrolidin-1-ylethanone Traditional Name: 2-(3-piperazin-4-ium-1-ylphenoxy)-1-pyrrolidino-ethanone Formula: C16H24N3O2+ MolecularWeight: 290.38066

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)COC2=CC=CC(=C2)N3CC[NH2+]CC3

Isomeric SMILES

C1CCN(C1)C(=O)COC2=CC=CC(=C2)N3CC[NH2+]CC3

InChI

InChI=1S/C16H23N3O2/c20-16(19-8-1-2-9-19)13-21-15-5-3-4-14(12-15)18-10-6-17-7-11-18/h3-5,12,17H,1-2,6-11,13H2/p+1