N-(3-methyl-5-nitro-imidazol-4-yl)-1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-amine

Systemtic Name: N-(3-methyl-5-nitro-imidazol-4-yl)-1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-amine Openeye Name: 1-benzyl-N-(3-methyl-5-nitro-imidazol-4-yl)-4,5,6,7-tetrahydroindazol-4-amine CAS Name: N-(3-methyl-5-nitro-4-imidazolyl)-1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-amine IUPAC Name: 1-benzyl-N-(3-methyl-5-nitroimidazol-4-yl)-4,5,6,7-tetrahydroindazol-4-amine Traditional Name: (1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-(3-methyl-5-nitro-imidazol-4-yl)amine Formula: C18H20N6O2 MolecularWeight: 352.3904

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1NC2CCCC3=C2C=NN3CC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1NC2CCCC3=C2C=NN3CC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H20N6O2/c1-22-12-19-17(24(25)26)18(22)21-15-8-5-9-16-14(15)10-20-23(16)11-13-6-3-2-4-7-13/h2-4,6-7,10,12,15,21H,5,8-9,11H2,1H3