2-[4-(3-fluorophenyl)carbonylpiperazin-1-ium-1-yl]-1-(4-methoxyphenyl)ethanone

Systemtic Name: 2-[4-(3-fluorophenyl)carbonylpiperazin-1-ium-1-yl]-1-(4-methoxyphenyl)ethanone Openeye Name: 2-[4-(3-fluorobenzoyl)piperazin-1-ium-1-yl]-1-(4-methoxyphenyl)ethanone CAS Name: 2-[4-[(3-fluorophenyl)-oxomethyl]-1-piperazin-1-iumyl]-1-(4-methoxyphenyl)ethanone IUPAC Name: 2-[4-(3-fluorobenzoyl)piperazin-1-ium-1-yl]-1-(4-methoxyphenyl)ethanone Traditional Name: 2-[4-(3-fluorobenzoyl)piperazin-1-ium-1-yl]-1-(4-methoxyphenyl)ethanone Formula: C20H22FN2O3+ MolecularWeight: 357.398683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC(=CC=C3)F

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C20H21FN2O3/c1-26-18-7-5-15(6-8-18)19(24)14-22-9-11-23(12-10-22)20(25)16-3-2-4-17(21)13-16/h2-8,13H,9-12,14H2,1H3/p+1