4-[(2-methyl-4-nitro-imidazol-1-yl)methyl]-1-(phenylmethyl)-1,2,3-triazole

Systemtic Name: 4-[(2-methyl-4-nitro-imidazol-1-yl)methyl]-1-(phenylmethyl)-1,2,3-triazole Openeye Name: 1-benzyl-4-[(2-methyl-4-nitro-imidazol-1-yl)methyl]triazole CAS Name: 4-[(2-methyl-4-nitro-1-imidazolyl)methyl]-1-(phenylmethyl)triazole IUPAC Name: 1-benzyl-4-[(2-methyl-4-nitroimidazol-1-yl)methyl]triazole Traditional Name: 1-benzyl-4-[(2-methyl-4-nitro-imidazol-1-yl)methyl]triazole Formula: C14H14N6O2 MolecularWeight: 298.29996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CN1CC2=CN(N=N2)CC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=CN1CC2=CN(N=N2)CC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H14N6O2/c1-11-15-14(20(21)22)10-18(11)8-13-9-19(17-16-13)7-12-5-3-2-4-6-12/h2-6,9-10H,7-8H2,1H3