ethyl 1-(4-propan-2-ylphenyl)-5-(pyridin-4-ylmethoxy)pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(4-propan-2-ylphenyl)-5-(pyridin-4-ylmethoxy)pyrazole-4-carboxylate Openeye Name: ethyl 1-(4-isopropylphenyl)-5-(4-pyridylmethoxy)pyrazole-4-carboxylate CAS Name: 1-(4-propan-2-ylphenyl)-5-(pyridin-4-ylmethoxy)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-propan-2-ylphenyl)-5-(pyridin-4-ylmethoxy)pyrazole-4-carboxylate Traditional Name: 1-p-cumenyl-5-(4-pyridylmethoxy)pyrazole-4-carboxylic acid ethyl ester Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(C)C)OCC3=CC=NC=C3

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(C)C)OCC3=CC=NC=C3

InChI

InChI=1S/C21H23N3O3/c1-4-26-21(25)19-13-23-24(18-7-5-17(6-8-18)15(2)3)20(19)27-14-16-9-11-22-12-10-16/h5-13,15H,4,14H2,1-3H3