[4-[(2,4-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]-(2-fluorophenyl)methanone

Systemtic Name: [4-[(2,4-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]-(2-fluorophenyl)methanone Openeye Name: [4-[(2,4-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]-(2-fluorophenyl)methanone CAS Name: [4-[(2,4-dimethoxyphenyl)methyl]-1-piperazin-4-iumyl]-(2-fluorophenyl)methanone IUPAC Name: [4-[(2,4-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]-(2-fluorophenyl)methanone Traditional Name: [4-(2,4-dimethoxybenzyl)piperazin-4-ium-1-yl]-(2-fluorophenyl)methanone Formula: C20H24FN2O3+ MolecularWeight: 359.414563

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3F)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3F)OC

InChI

InChI=1S/C20H23FN2O3/c1-25-16-8-7-15(19(13-16)26-2)14-22-9-11-23(12-10-22)20(24)17-5-3-4-6-18(17)21/h3-8,13H,9-12,14H2,1-2H3/p+1