1-(4-ethylpiperazin-4-ium-1-yl)-2-(5-methyl-2-propan-2-yl-phenoxy)ethanone

Systemtic Name: 1-(4-ethylpiperazin-4-ium-1-yl)-2-(5-methyl-2-propan-2-yl-phenoxy)ethanone Openeye Name: 1-(4-ethylpiperazin-4-ium-1-yl)-2-(2-isopropyl-5-methyl-phenoxy)ethanone CAS Name: 1-(4-ethyl-1-piperazin-4-iumyl)-2-(5-methyl-2-propan-2-ylphenoxy)ethanone IUPAC Name: 1-(4-ethylpiperazin-4-ium-1-yl)-2-(5-methyl-2-propan-2-ylphenoxy)ethanone Traditional Name: 1-(4-ethylpiperazin-4-ium-1-yl)-2-(2-isopropyl-5-methyl-phenoxy)ethanone Formula: C18H29N2O2+ MolecularWeight: 305.43506

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)COC2=C(C=CC(=C2)C)C(C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)COC2=C(C=CC(=C2)C)C(C)C

InChI

InChI=1S/C18H28N2O2/c1-5-19-8-10-20(11-9-19)18(21)13-22-17-12-15(4)6-7-16(17)14(2)3/h6-7,12,14H,5,8-11,13H2,1-4H3/p+1