N-[1-(4-fluoranylphenoxy)-3-(1,2,4-triazol-1-yl)propan-2-yl]-4-iodanyl-benzamide

Systemtic Name: N-[1-(4-fluoranylphenoxy)-3-(1,2,4-triazol-1-yl)propan-2-yl]-4-iodanyl-benzamide Openeye Name: N-[1-[(4-fluorophenoxy)methyl]-2-(1,2,4-triazol-1-yl)ethyl]-4-iodo-benzamide CAS Name: N-[1-(4-fluorophenoxy)-3-(1,2,4-triazol-1-yl)propan-2-yl]-4-iodobenzamide IUPAC Name: N-[1-(4-fluorophenoxy)-3-(1,2,4-triazol-1-yl)propan-2-yl]-4-iodobenzamide Traditional Name: N-[1-[(4-fluorophenoxy)methyl]-2-(1,2,4-triazol-1-yl)ethyl]-4-iodo-benzamide Formula: C18H16FIN4O2 MolecularWeight: 466.248113

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC(CN2C=NC=N2)COC3=CC=C(C=C3)F)I

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC(CN2C=NC=N2)COC3=CC=C(C=C3)F)I

InChI

InChI=1S/C18H16FIN4O2/c19-14-3-7-17(8-4-14)26-10-16(9-24-12-21-11-22-24)23-18(25)13-1-5-15(20)6-2-13/h1-8,11-12,16H,9-10H2,(H,23,25)