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

Systemtic Name: ethyl 5-(nonanoylamino)-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-(nonanoylamino)-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-(1-oxononylamino)-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(nonanoylamino)-1-phenylpyrazole-4-carboxylate Traditional Name: 5-(pelargonylamino)-1-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C21H29N3O3 MolecularWeight: 371.47326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3O3/c1-3-5-6-7-8-12-15-19(25)23-20-18(21(26)27-4-2)16-22-24(20)17-13-10-9-11-14-17/h9-11,13-14,16H,3-8,12,15H2,1-2H3,(H,23,25)