2-[5-(4-fluorophenyl)-2-(1H-pyrazol-5-yl)-4-pyridin-4-yl-morpholin-4-ium-4-yl]ethanamine

Systemtic Name: 2-[5-(4-fluorophenyl)-2-(1H-pyrazol-5-yl)-4-pyridin-4-yl-morpholin-4-ium-4-yl]ethanamine Openeye Name: 2-[5-(4-fluorophenyl)-2-(1H-pyrazol-5-yl)-4-(4-pyridyl)morpholin-4-ium-4-yl]ethanamine CAS Name: 2-[5-(4-fluorophenyl)-2-(1H-pyrazol-5-yl)-4-pyridin-4-yl-4-morpholin-4-iumyl]ethanamine IUPAC Name: 2-[5-(4-fluorophenyl)-2-(1H-pyrazol-5-yl)-4-pyridin-4-ylmorpholin-4-ium-4-yl]ethanamine Traditional Name: 2-[5-(4-fluorophenyl)-2-(1H-pyrazol-5-yl)-4-(4-pyridyl)morpholin-4-ium-4-yl]ethylamine Formula: C20H23FN5O+ MolecularWeight: 368.427923

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OCC([N+]1(CCN)C2=CC=NC=C2)C3=CC=C(C=C3)F)C4=CC=NN4

Isomeric SMILES

C1C(OCC([N+]1(CCN)C2=CC=NC=C2)C3=CC=C(C=C3)F)C4=CC=NN4

InChI

InChI=1S/C20H23FN5O/c21-16-3-1-15(2-4-16)19-14-27-20(18-7-11-24-25-18)13-26(19,12-8-22)17-5-9-23-10-6-17/h1-7,9-11,19-20H,8,12-14,22H2,(H,24,25)/q+1