2-iodanyl-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide

Systemtic Name: 2-iodanyl-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide Openeye Name: 2-iodo-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide CAS Name: 2-iodo-N-[2-[4-(1-pyrazolyl)phenyl]ethyl]benzamide IUPAC Name: 2-iodo-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide Traditional Name: 2-iodo-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide Formula: C18H16IN3O MolecularWeight: 417.24361

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NCCC2=CC=C(C=C2)N3C=CC=N3)I

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NCCC2=CC=C(C=C2)N3C=CC=N3)I

InChI

InChI=1S/C18H16IN3O/c19-17-5-2-1-4-16(17)18(23)20-12-10-14-6-8-15(9-7-14)22-13-3-11-21-22/h1-9,11,13H,10,12H2,(H,20,23)