2-(4-fluorophenyl)-4-[(morpholin-4-ylamino)methyl]-5-propyl-pyrazol-3-olate

Systemtic Name: 2-(4-fluorophenyl)-4-[(morpholin-4-ylamino)methyl]-5-propyl-pyrazol-3-olate Openeye Name: 2-(4-fluorophenyl)-4-[(morpholinoamino)methyl]-5-propyl-pyrazol-3-olate CAS Name: 2-(4-fluorophenyl)-4-[(4-morpholinylamino)methyl]-5-propyl-3-pyrazololate IUPAC Name: 2-(4-fluorophenyl)-4-[(morpholin-4-ylamino)methyl]-5-propylpyrazol-3-olate Traditional Name: 2-(4-fluorophenyl)-4-[(morpholinoamino)methyl]-5-propyl-pyrazol-3-olate Formula: C17H22FN4O2- MolecularWeight: 333.380583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1CNN2CCOCC2)[O-])C3=CC=C(C=C3)F

Isomeric SMILES

CCCC1=NN(C(=C1CNN2CCOCC2)[O-])C3=CC=C(C=C3)F

InChI

InChI=1S/C17H23FN4O2/c1-2-3-16-15(12-19-21-8-10-24-11-9-21)17(23)22(20-16)14-6-4-13(18)5-7-14/h4-7,19,23H,2-3,8-12H2,1H3/p-1