[(2S)-3-ethoxy-2-oxidanyl-propyl]-[[5-(3-fluoranyl-4-methoxy-phenyl)-1H-pyrazol-4-yl]methyl]azanium

Systemtic Name: [(2S)-3-ethoxy-2-oxidanyl-propyl]-[[5-(3-fluoranyl-4-methoxy-phenyl)-1H-pyrazol-4-yl]methyl]azanium Openeye Name: [(2S)-3-ethoxy-2-hydroxy-propyl]-[[5-(3-fluoro-4-methoxy-phenyl)-1H-pyrazol-4-yl]methyl]ammonium CAS Name: [(2S)-3-ethoxy-2-hydroxypropyl]-[[5-(3-fluoro-4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]ammonium IUPAC Name: [(2S)-3-ethoxy-2-hydroxypropyl]-[[5-(3-fluoro-4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]azanium Traditional Name: [(2S)-3-ethoxy-2-hydroxy-propyl]-[[5-(3-fluoro-4-methoxy-phenyl)-1H-pyrazol-4-yl]methyl]ammonium Formula: C16H23FN3O3+ MolecularWeight: 324.370523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCC(C[NH2+]CC1=C(NN=C1)C2=CC(=C(C=C2)OC)F)O

Isomeric SMILES

CCOC[C@H](C[NH2+]CC1=C(NN=C1)C2=CC(=C(C=C2)OC)F)O

InChI

InChI=1S/C16H22FN3O3/c1-3-23-10-13(21)9-18-7-12-8-19-20-16(12)11-4-5-15(22-2)14(17)6-11/h4-6,8,13,18,21H,3,7,9-10H2,1-2H3,(H,19,20)/p+1/t13-/m0/s1