ethyl 1-(3-fluorophenyl)-5-[(2-hydroxyethylamino)methyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(3-fluorophenyl)-5-[(2-hydroxyethylamino)methyl]pyrazole-4-carboxylate Openeye Name: ethyl 1-(3-fluorophenyl)-5-[(2-hydroxyethylamino)methyl]pyrazole-4-carboxylate CAS Name: 1-(3-fluorophenyl)-5-[(2-hydroxyethylamino)methyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-fluorophenyl)-5-[(2-hydroxyethylamino)methyl]pyrazole-4-carboxylate Traditional Name: 1-(3-fluorophenyl)-5-[(2-hydroxyethylamino)methyl]pyrazole-4-carboxylic acid ethyl ester Formula: C15H18FN3O3 MolecularWeight: 307.320123

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)F)CNCCO

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)F)CNCCO

InChI

InChI=1S/C15H18FN3O3/c1-2-22-15(21)13-9-18-19(14(13)10-17-6-7-20)12-5-3-4-11(16)8-12/h3-5,8-9,17,20H,2,6-7,10H2,1H3