azepan-1-yl-[4-[[(3-methyl-5-nitro-imidazol-4-yl)amino]methyl]phenyl]methanone

Systemtic Name: azepan-1-yl-[4-[[(3-methyl-5-nitro-imidazol-4-yl)amino]methyl]phenyl]methanone Openeye Name: azepan-1-yl-[4-[[(3-methyl-5-nitro-imidazol-4-yl)amino]methyl]phenyl]methanone CAS Name: 1-azepanyl-[4-[[(3-methyl-5-nitro-4-imidazolyl)amino]methyl]phenyl]methanone IUPAC Name: azepan-1-yl-[4-[[(3-methyl-5-nitroimidazol-4-yl)amino]methyl]phenyl]methanone Traditional Name: azepan-1-yl-[4-[[(3-methyl-5-nitro-imidazol-4-yl)amino]methyl]phenyl]methanone Formula: C18H23N5O3 MolecularWeight: 357.40692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1NCC2=CC=C(C=C2)C(=O)N3CCCCCC3)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1NCC2=CC=C(C=C2)C(=O)N3CCCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H23N5O3/c1-21-13-20-17(23(25)26)16(21)19-12-14-6-8-15(9-7-14)18(24)22-10-4-2-3-5-11-22/h6-9,13,19H,2-5,10-12H2,1H3