2-[4-[5-[(4-fluoranylphenoxy)methyl]furan-2-yl]carbonylpiperazin-1-ium-1-yl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[4-[5-[(4-fluoranylphenoxy)methyl]furan-2-yl]carbonylpiperazin-1-ium-1-yl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[4-[5-[(4-fluorophenoxy)methyl]furan-2-carbonyl]piperazin-1-ium-1-yl]-1-(1-piperidyl)ethanone CAS Name: 2-[4-[[5-[(4-fluorophenoxy)methyl]-2-furanyl]-oxomethyl]-1-piperazin-1-iumyl]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[4-[5-[(4-fluorophenoxy)methyl]furan-2-carbonyl]piperazin-1-ium-1-yl]-1-piperidin-1-ylethanone Traditional Name: 2-[4-[5-[(4-fluorophenoxy)methyl]-2-furoyl]piperazin-1-ium-1-yl]-1-piperidino-ethanone Formula: C23H29FN3O4+ MolecularWeight: 430.492463

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=C(O3)COC4=CC=C(C=C4)F

Isomeric SMILES

C1CCN(CC1)C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=C(O3)COC4=CC=C(C=C4)F

InChI

InChI=1S/C23H28FN3O4/c24-18-4-6-19(7-5-18)30-17-20-8-9-21(31-20)23(29)27-14-12-25(13-15-27)16-22(28)26-10-2-1-3-11-26/h4-9H,1-3,10-17H2/p+1