1-[(4-chloranyl-3,5-dimethyl-phenoxy)methyl]-N-(4-ethoxyphenyl)pyrazole-3-carboxamide

Systemtic Name: 1-[(4-chloranyl-3,5-dimethyl-phenoxy)methyl]-N-(4-ethoxyphenyl)pyrazole-3-carboxamide Openeye Name: 1-[(4-chloro-3,5-dimethyl-phenoxy)methyl]-N-(4-ethoxyphenyl)pyrazole-3-carboxamide CAS Name: 1-[(4-chloro-3,5-dimethylphenoxy)methyl]-N-(4-ethoxyphenyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(4-chloro-3,5-dimethylphenoxy)methyl]-N-(4-ethoxyphenyl)pyrazole-3-carboxamide Traditional Name: 1-[(4-chloro-3,5-dimethyl-phenoxy)methyl]-N-p-phenetyl-pyrazole-3-carboxamide Formula: C21H22ClN3O3 MolecularWeight: 399.87068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=NN(C=C2)COC3=CC(=C(C(=C3)C)Cl)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=NN(C=C2)COC3=CC(=C(C(=C3)C)Cl)C

InChI

InChI=1S/C21H22ClN3O3/c1-4-27-17-7-5-16(6-8-17)23-21(26)19-9-10-25(24-19)13-28-18-11-14(2)20(22)15(3)12-18/h5-12H,4,13H2,1-3H3,(H,23,26)