(6-chloranylpyridin-3-yl)-[4-[(3-iodanylphenyl)methyl]-1,4-diazepan-1-yl]methanone

Systemtic Name: (6-chloranylpyridin-3-yl)-[4-[(3-iodanylphenyl)methyl]-1,4-diazepan-1-yl]methanone Openeye Name: (6-chloro-3-pyridyl)-[4-[(3-iodophenyl)methyl]-1,4-diazepan-1-yl]methanone CAS Name: (6-chloro-3-pyridinyl)-[4-[(3-iodophenyl)methyl]-1,4-diazepan-1-yl]methanone IUPAC Name: (6-chloropyridin-3-yl)-[4-[(3-iodophenyl)methyl]-1,4-diazepan-1-yl]methanone Traditional Name: (6-chloro-3-pyridyl)-[4-(3-iodobenzyl)-1,4-diazepan-1-yl]methanone Formula: C18H19ClIN3O MolecularWeight: 455.72043

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=CN=C(C=C2)Cl)CC3=CC(=CC=C3)I

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CN=C(C=C2)Cl)CC3=CC(=CC=C3)I

InChI

InChI=1S/C18H19ClIN3O/c19-17-6-5-15(12-21-17)18(24)23-8-2-7-22(9-10-23)13-14-3-1-4-16(20)11-14/h1,3-6,11-12H,2,7-10,13H2