2-(4-phenylphenoxy)-1-(4-prop-2-enylpiperazin-4-ium-1-yl)ethanone

Systemtic Name: 2-(4-phenylphenoxy)-1-(4-prop-2-enylpiperazin-4-ium-1-yl)ethanone Openeye Name: 1-(4-allylpiperazin-4-ium-1-yl)-2-(4-phenylphenoxy)ethanone CAS Name: 2-(4-phenylphenoxy)-1-(4-prop-2-enyl-1-piperazin-4-iumyl)ethanone IUPAC Name: 2-(4-phenylphenoxy)-1-(4-prop-2-enylpiperazin-4-ium-1-yl)ethanone Traditional Name: 1-(4-allylpiperazin-4-ium-1-yl)-2-(4-phenylphenoxy)ethanone Formula: C21H25N2O2+ MolecularWeight: 337.4354

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH+]1CCN(CC1)C(=O)COC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

C=CC[NH+]1CCN(CC1)C(=O)COC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H24N2O2/c1-2-12-22-13-15-23(16-14-22)21(24)17-25-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h2-11H,1,12-17H2/p+1