(4-ethylpiperazin-1-yl)-(2-iodanyl-5-nitro-phenyl)methanone

Systemtic Name: (4-ethylpiperazin-1-yl)-(2-iodanyl-5-nitro-phenyl)methanone Openeye Name: (4-ethylpiperazin-1-yl)-(2-iodo-5-nitro-phenyl)methanone CAS Name: (4-ethyl-1-piperazinyl)-(2-iodo-5-nitrophenyl)methanone IUPAC Name: (4-ethylpiperazin-1-yl)-(2-iodo-5-nitrophenyl)methanone Traditional Name: (4-ethylpiperazino)-(2-iodo-5-nitro-phenyl)methanone Formula: C13H16IN3O3 MolecularWeight: 389.18891

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])I

Isomeric SMILES

CCN1CCN(CC1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])I

InChI

InChI=1S/C13H16IN3O3/c1-2-15-5-7-16(8-6-15)13(18)11-9-10(17(19)20)3-4-12(11)14/h3-4,9H,2,5-8H2,1H3