1-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-[(4-methylphenoxy)methyl]-1,2,3-triazole

Systemtic Name: 1-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-[(4-methylphenoxy)methyl]-1,2,3-triazole Openeye Name: 1-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-[(4-methylphenoxy)methyl]triazole CAS Name: 1-[2-(2-methyl-5-nitro-1-imidazolyl)ethyl]-4-[(4-methylphenoxy)methyl]triazole IUPAC Name: 1-[2-(2-methyl-5-nitroimidazol-1-yl)ethyl]-4-[(4-methylphenoxy)methyl]triazole Traditional Name: 1-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-[(4-methylphenoxy)methyl]triazole Formula: C16H18N6O3 MolecularWeight: 342.35252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC2=CN(N=N2)CCN3C(=NC=C3[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)OCC2=CN(N=N2)CCN3C(=NC=C3[N+](=O)[O-])C

InChI

InChI=1S/C16H18N6O3/c1-12-3-5-15(6-4-12)25-11-14-10-20(19-18-14)7-8-21-13(2)17-9-16(21)22(23)24/h3-6,9-10H,7-8,11H2,1-2H3