2-[4-(2-methylbutan-2-yl)phenoxy]-1-piperazin-4-ium-1-yl-ethanone

Systemtic Name: 2-[4-(2-methylbutan-2-yl)phenoxy]-1-piperazin-4-ium-1-yl-ethanone Openeye Name: 2-[4-(1,1-dimethylpropyl)phenoxy]-1-piperazin-4-ium-1-yl-ethanone CAS Name: 2-[4-(2-methylbutan-2-yl)phenoxy]-1-(1-piperazin-4-iumyl)ethanone IUPAC Name: 2-[4-(2-methylbutan-2-yl)phenoxy]-1-piperazin-4-ium-1-ylethanone Traditional Name: 2-(4-tert-amylphenoxy)-1-piperazin-4-ium-1-yl-ethanone Formula: C17H27N2O2+ MolecularWeight: 291.40848

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OCC(=O)N2CC[NH2+]CC2

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OCC(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C17H26N2O2/c1-4-17(2,3)14-5-7-15(8-6-14)21-13-16(20)19-11-9-18-10-12-19/h5-8,18H,4,9-13H2,1-3H3/p+1