ethyl 5-(3-cyclohexylpropanoylamino)-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-(3-cyclohexylpropanoylamino)-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-(3-cyclohexylpropanoylamino)-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-[(3-cyclohexyl-1-oxopropyl)amino]-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(3-cyclohexylpropanoylamino)-1-phenylpyrazole-4-carboxylate Traditional Name: 5-(3-cyclohexylpropanoylamino)-1-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)CCC3CCCCC3

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)CCC3CCCCC3

InChI

InChI=1S/C21H27N3O3/c1-2-27-21(26)18-15-22-24(17-11-7-4-8-12-17)20(18)23-19(25)14-13-16-9-5-3-6-10-16/h4,7-8,11-12,15-16H,2-3,5-6,9-10,13-14H2,1H3,(H,23,25)