ethyl 4-[[5-(3-fluoranyl-4-methoxy-phenyl)-1H-pyrazol-4-yl]methyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[5-(3-fluoranyl-4-methoxy-phenyl)-1H-pyrazol-4-yl]methyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[[5-(3-fluoro-4-methoxy-phenyl)-1H-pyrazol-4-yl]methyl]piperazine-1-carboxylate CAS Name: 4-[[5-(3-fluoro-4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[5-(3-fluoro-4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]piperazine-1-carboxylate Traditional Name: 4-[[5-(3-fluoro-4-methoxy-phenyl)-1H-pyrazol-4-yl]methyl]piperazine-1-carboxylic acid ethyl ester Formula: C18H23FN4O3 MolecularWeight: 362.398623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC2=C(NN=C2)C3=CC(=C(C=C3)OC)F

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC2=C(NN=C2)C3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C18H23FN4O3/c1-3-26-18(24)23-8-6-22(7-9-23)12-14-11-20-21-17(14)13-4-5-16(25-2)15(19)10-13/h4-5,10-11H,3,6-9,12H2,1-2H3,(H,20,21)