N-[4-(4-fluoranylphenoxy)butyl]-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-[4-(4-fluoranylphenoxy)butyl]-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-[4-(4-fluorophenoxy)butyl]pyrazole-4-carboxamide CAS Name: N-[4-(4-fluorophenoxy)butyl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-[4-(4-fluorophenoxy)butyl]pyrazole-4-carboxamide Traditional Name: 1-benzyl-N-[4-(4-fluorophenoxy)butyl]pyrazole-4-carboxamide Formula: C21H22FN3O2 MolecularWeight: 367.416683

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C=N2)C(=O)NCCCCOC3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C=N2)C(=O)NCCCCOC3=CC=C(C=C3)F

InChI

InChI=1S/C21H22FN3O2/c22-19-8-10-20(11-9-19)27-13-5-4-12-23-21(26)18-14-24-25(16-18)15-17-6-2-1-3-7-17/h1-3,6-11,14,16H,4-5,12-13,15H2,(H,23,26)