azepan-1-yl-(3-iodanyl-5-nitro-phenyl)methanimine hydrochloride

Systemtic Name: azepan-1-yl-(3-iodanyl-5-nitro-phenyl)methanimine hydrochloride Openeye Name: azepan-1-yl-(3-iodo-5-nitro-phenyl)methanimine hydrochloride CAS Name: 1-azepanyl-(3-iodo-5-nitrophenyl)methanimine hydrochloride IUPAC Name: azepan-1-yl-(3-iodo-5-nitrophenyl)methanimine hydrochloride Traditional Name: [azepan-1-yl-(3-iodo-5-nitro-phenyl)methylene]amine hydrochloride Formula: C13H17ClIN3O2 MolecularWeight: 409.65045

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=N)C2=CC(=CC(=C2)I)[N+](=O)[O-].Cl

Isomeric SMILES

C1CCCN(CC1)C(=N)C2=CC(=CC(=C2)I)[N+](=O)[O-].Cl

InChI

InChI=1S/C13H16IN3O2.ClH/c14-11-7-10(8-12(9-11)17(18)19)13(15)16-5-3-1-2-4-6-16;/h7-9,15H,1-6H2;1H