1,4-diazepan-1-yl-(3-iodanylphenyl)methanone

Systemtic Name: 1,4-diazepan-1-yl-(3-iodanylphenyl)methanone Openeye Name: 1,4-diazepan-1-yl-(3-iodophenyl)methanone CAS Name: 1,4-diazepan-1-yl-(3-iodophenyl)methanone IUPAC Name: 1,4-diazepan-1-yl-(3-iodophenyl)methanone Traditional Name: 1,4-diazepan-1-yl-(3-iodophenyl)methanone Formula: C12H15IN2O MolecularWeight: 330.16477

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15IN2O/c13-11-4-1-3-10(9-11)12(16)15-7-2-5-14-6-8-15/h1,3-4,9,14H,2,5-8H2