azepan-1-yl-[3,4-bis(chloranyl)-5-nitro-phenyl]methanone

Systemtic Name: azepan-1-yl-[3,4-bis(chloranyl)-5-nitro-phenyl]methanone Openeye Name: azepan-1-yl-(3,4-dichloro-5-nitro-phenyl)methanone CAS Name: 1-azepanyl-(3,4-dichloro-5-nitrophenyl)methanone IUPAC Name: azepan-1-yl-(3,4-dichloro-5-nitrophenyl)methanone Traditional Name: azepan-1-yl-(3,4-dichloro-5-nitro-phenyl)methanone Formula: C13H14Cl2N2O3 MolecularWeight: 317.16786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14Cl2N2O3/c14-10-7-9(8-11(12(10)15)17(19)20)13(18)16-5-3-1-2-4-6-16/h7-8H,1-6H2