ethyl 1-(3-chlorophenyl)-5-[(1,2-oxazol-3-ylmethylamino)methyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(3-chlorophenyl)-5-[(1,2-oxazol-3-ylmethylamino)methyl]pyrazole-4-carboxylate Openeye Name: ethyl 1-(3-chlorophenyl)-5-[(isoxazol-3-ylmethylamino)methyl]pyrazole-4-carboxylate CAS Name: 1-(3-chlorophenyl)-5-[(3-isoxazolylmethylamino)methyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-chlorophenyl)-5-[(1,2-oxazol-3-ylmethylamino)methyl]pyrazole-4-carboxylate Traditional Name: 1-(3-chlorophenyl)-5-[(isoxazol-3-ylmethylamino)methyl]pyrazole-4-carboxylic acid ethyl ester Formula: C17H17ClN4O3 MolecularWeight: 360.79488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)Cl)CNCC3=NOC=C3

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)Cl)CNCC3=NOC=C3

InChI

InChI=1S/C17H17ClN4O3/c1-2-24-17(23)15-10-20-22(14-5-3-4-12(18)8-14)16(15)11-19-9-13-6-7-25-21-13/h3-8,10,19H,2,9,11H2,1H3