ethyl 5-(butanoylamino)-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-(butanoylamino)-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-(butanoylamino)-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-(1-oxobutylamino)-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(butanoylamino)-1-phenylpyrazole-4-carboxylate Traditional Name: 5-butyramido-1-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C16H19N3O3 MolecularWeight: 301.34036

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C=NN1C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCCC(=O)NC1=C(C=NN1C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C16H19N3O3/c1-3-8-14(20)18-15-13(16(21)22-4-2)11-17-19(15)12-9-6-5-7-10-12/h5-7,9-11H,3-4,8H2,1-2H3,(H,18,20)