N-(2,2-dimethoxyethyl)-1-(4-fluorophenyl)-4-phenylmethoxy-pyrazole-3-carboxamide

Systemtic Name: N-(2,2-dimethoxyethyl)-1-(4-fluorophenyl)-4-phenylmethoxy-pyrazole-3-carboxamide Openeye Name: 4-benzyloxy-N-(2,2-dimethoxyethyl)-1-(4-fluorophenyl)pyrazole-3-carboxamide CAS Name: N-(2,2-dimethoxyethyl)-1-(4-fluorophenyl)-4-phenylmethoxy-3-pyrazolecarboxamide IUPAC Name: N-(2,2-dimethoxyethyl)-1-(4-fluorophenyl)-4-phenylmethoxypyrazole-3-carboxamide Traditional Name: 4-benzoxy-N-(2,2-dimethoxyethyl)-1-(4-fluorophenyl)pyrazole-3-carboxamide Formula: C21H22FN3O4 MolecularWeight: 399.415483

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Descriptors Computed from Structure

Canonical SMILES:

COC(CNC(=O)C1=NN(C=C1OCC2=CC=CC=C2)C3=CC=C(C=C3)F)OC

Isomeric SMILES

COC(CNC(=O)C1=NN(C=C1OCC2=CC=CC=C2)C3=CC=C(C=C3)F)OC

InChI

InChI=1S/C21H22FN3O4/c1-27-19(28-2)12-23-21(26)20-18(29-14-15-6-4-3-5-7-15)13-25(24-20)17-10-8-16(22)9-11-17/h3-11,13,19H,12,14H2,1-2H3,(H,23,26)