2-(1,4-diazepan-1-yl)-N-(3-iodanylphenyl)-2-oxidanylidene-ethanamide

Systemtic Name: 2-(1,4-diazepan-1-yl)-N-(3-iodanylphenyl)-2-oxidanylidene-ethanamide Openeye Name: 2-(1,4-diazepan-1-yl)-N-(3-iodophenyl)-2-oxo-acetamide CAS Name: 2-(1,4-diazepan-1-yl)-N-(3-iodophenyl)-2-oxoacetamide IUPAC Name: 2-(1,4-diazepan-1-yl)-N-(3-iodophenyl)-2-oxoacetamide Traditional Name: 2-(1,4-diazepan-1-yl)-N-(3-iodophenyl)-2-keto-acetamide Formula: C13H16IN3O2 MolecularWeight: 373.18951

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(=O)C(=O)NC2=CC(=CC=C2)I

Isomeric SMILES

C1CNCCN(C1)C(=O)C(=O)NC2=CC(=CC=C2)I

InChI

InChI=1S/C13H16IN3O2/c14-10-3-1-4-11(9-10)16-12(18)13(19)17-7-2-5-15-6-8-17/h1,3-4,9,15H,2,5-8H2,(H,16,18)