3-(3-imidazol-1-yl-2-methyl-propyl)-6-nitro-1,2,3-benzotriazin-4-one

Systemtic Name: 3-(3-imidazol-1-yl-2-methyl-propyl)-6-nitro-1,2,3-benzotriazin-4-one Openeye Name: 3-(3-imidazol-1-yl-2-methyl-propyl)-6-nitro-1,2,3-benzotriazin-4-one CAS Name: 3-[3-(1-imidazolyl)-2-methylpropyl]-6-nitro-1,2,3-benzotriazin-4-one IUPAC Name: 3-(3-imidazol-1-yl-2-methylpropyl)-6-nitro-1,2,3-benzotriazin-4-one Traditional Name: 3-(3-imidazol-1-yl-2-methyl-propyl)-6-nitro-1,2,3-benzotriazin-4-one Formula: C14H14N6O3 MolecularWeight: 314.29936

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=CN=C1)CN2C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N=N2

Isomeric SMILES

CC(CN1C=CN=C1)CN2C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N=N2

InChI

InChI=1S/C14H14N6O3/c1-10(7-18-5-4-15-9-18)8-19-14(21)12-6-11(20(22)23)2-3-13(12)16-17-19/h2-6,9-10H,7-8H2,1H3