[5-(4-fluoranylphenoxy)-3-methyl-1-phenyl-pyrazol-4-yl]methyl-(2-morpholin-4-ylethyl)azanium

Systemtic Name: [5-(4-fluoranylphenoxy)-3-methyl-1-phenyl-pyrazol-4-yl]methyl-(2-morpholin-4-ylethyl)azanium Openeye Name: [5-(4-fluorophenoxy)-3-methyl-1-phenyl-pyrazol-4-yl]methyl-(2-morpholinoethyl)ammonium CAS Name: [5-(4-fluorophenoxy)-3-methyl-1-phenyl-4-pyrazolyl]methyl-[2-(4-morpholinyl)ethyl]ammonium IUPAC Name: [5-(4-fluorophenoxy)-3-methyl-1-phenylpyrazol-4-yl]methyl-(2-morpholin-4-ylethyl)azanium Traditional Name: [5-(4-fluorophenoxy)-3-methyl-1-phenyl-pyrazol-4-yl]methyl-(2-morpholinoethyl)ammonium Formula: C23H28FN4O2+ MolecularWeight: 411.492423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C[NH2+]CCN2CCOCC2)OC3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C[NH2+]CCN2CCOCC2)OC3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C23H27FN4O2/c1-18-22(17-25-11-12-27-13-15-29-16-14-27)23(30-21-9-7-19(24)8-10-21)28(26-18)20-5-3-2-4-6-20/h2-10,25H,11-17H2,1H3/p+1