3-iodanylbenzamide; octanoic acid

Systemtic Name: 3-iodanylbenzamide; octanoic acid Openeye Name: 3-iodobenzamide; octanoic acid CAS Name: 3-iodobenzamide; octanoic acid IUPAC Name: 3-iodobenzamide; octanoic acid Traditional Name: caprylic acid; 3-iodobenzamide Formula: C15H22INO3 MolecularWeight: 391.24455

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)O.C1=CC(=CC(=C1)I)C(=O)N

Isomeric SMILES

CCCCCCCC(=O)O.C1=CC(=CC(=C1)I)C(=O)N

InChI

InChI=1S/C8H16O2.C7H6INO/c1-2-3-4-5-6-7-8(9)10;8-6-3-1-2-5(4-6)7(9)10/h2-7H2,1H3,(H,9,10);1-4H,(H2,9,10)