2-iodanyl-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzamide

Systemtic Name: 2-iodanyl-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzamide Openeye Name: 2-iodo-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzamide CAS Name: 2-iodo-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzamide IUPAC Name: 2-iodo-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzamide Traditional Name: 2-iodo-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzamide Formula: C16H13IN4O MolecularWeight: 404.20509

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)CN3C=NC=N3)I

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)CN3C=NC=N3)I

InChI

InChI=1S/C16H13IN4O/c17-15-4-2-1-3-14(15)16(22)20-13-7-5-12(6-8-13)9-21-11-18-10-19-21/h1-8,10-11H,9H2,(H,20,22)