2-[4-[[5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methyl]piperazin-4-ium-1-yl]phenol

Systemtic Name: 2-[4-[[5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methyl]piperazin-4-ium-1-yl]phenol Openeye Name: 2-[4-[[5-(4-fluorophenyl)-4-methyl-isoxazol-3-yl]methyl]piperazin-4-ium-1-yl]phenol CAS Name: 2-[4-[[5-(4-fluorophenyl)-4-methyl-3-isoxazolyl]methyl]-1-piperazin-4-iumyl]phenol IUPAC Name: 2-[4-[[5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methyl]piperazin-4-ium-1-yl]phenol Traditional Name: 2-[4-[[5-(4-fluorophenyl)-4-methyl-isoxazol-3-yl]methyl]piperazin-4-ium-1-yl]phenol Formula: C21H23FN3O2+ MolecularWeight: 368.424623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(ON=C1C[NH+]2CCN(CC2)C3=CC=CC=C3O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(ON=C1C[NH+]2CCN(CC2)C3=CC=CC=C3O)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H22FN3O2/c1-15-18(23-27-21(15)16-6-8-17(22)9-7-16)14-24-10-12-25(13-11-24)19-4-2-3-5-20(19)26/h2-9,26H,10-14H2,1H3/p+1