O5-cyclohexyl O3-ethyl 5-(phenylcarbonyl)-1,4-dihydropyrazole-3,5-dicarboxylate

Systemtic Name: O5-cyclohexyl O3-ethyl 5-(phenylcarbonyl)-1,4-dihydropyrazole-3,5-dicarboxylate Openeye Name: O5-cyclohexyl O3-ethyl 5-benzoyl-1,4-dihydropyrazole-3,5-dicarboxylate CAS Name: 5-benzoyl-1,4-dihydropyrazole-3,5-dicarboxylic acid O5-cyclohexyl ester O3-ethyl ester IUPAC Name: 5-O-cyclohexyl 3-O-ethyl 5-benzoyl-1,4-dihydropyrazole-3,5-dicarboxylate Traditional Name: 3-benzoyl-2-pyrazoline-3,5-dicarboxylic acid O3-cyclohexyl ester O5-ethyl ester Formula: C20H24N2O5 MolecularWeight: 372.41496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NNC(C1)(C(=O)C2=CC=CC=C2)C(=O)OC3CCCCC3

Isomeric SMILES

CCOC(=O)C1=NNC(C1)(C(=O)C2=CC=CC=C2)C(=O)OC3CCCCC3

InChI

InChI=1S/C20H24N2O5/c1-2-26-18(24)16-13-20(22-21-16,17(23)14-9-5-3-6-10-14)19(25)27-15-11-7-4-8-12-15/h3,5-6,9-10,15,22H,2,4,7-8,11-13H2,1H3