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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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