4-[[1-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-1,2,3-triazol-4-yl]methoxy]benzaldehyde

Systemtic Name: 4-[[1-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-1,2,3-triazol-4-yl]methoxy]benzaldehyde Openeye Name: 4-[[1-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]triazol-4-yl]methoxy]benzaldehyde CAS Name: 4-[[1-[2-(2-methyl-5-nitro-1-imidazolyl)ethyl]-4-triazolyl]methoxy]benzaldehyde IUPAC Name: 4-[[1-[2-(2-methyl-5-nitroimidazol-1-yl)ethyl]triazol-4-yl]methoxy]benzaldehyde Traditional Name: 4-[[1-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]triazol-4-yl]methoxy]benzaldehyde Formula: C16H16N6O4 MolecularWeight: 356.33604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCN2C=C(N=N2)COC3=CC=C(C=C3)C=O)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1CCN2C=C(N=N2)COC3=CC=C(C=C3)C=O)[N+](=O)[O-]

InChI

InChI=1S/C16H16N6O4/c1-12-17-8-16(22(24)25)21(12)7-6-20-9-14(18-19-20)11-26-15-4-2-13(10-23)3-5-15/h2-5,8-10H,6-7,11H2,1H3