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

Systemtic Name: ethyl 5-(heptanoylamino)-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-(heptanoylamino)-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-(1-oxoheptylamino)-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(heptanoylamino)-1-phenylpyrazole-4-carboxylate Traditional Name: 5-(enanthylamino)-1-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C19H25N3O3 MolecularWeight: 343.4201

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3O3/c1-3-5-6-10-13-17(23)21-18-16(19(24)25-4-2)14-20-22(18)15-11-8-7-9-12-15/h7-9,11-12,14H,3-6,10,13H2,1-2H3,(H,21,23)