2-(2-ethoxy-3-nitro-phenyl)-5-methyl-7-propyl-1H-imidazo[5,1-f][1,2,4]triazin-4-one

Systemtic Name: 2-(2-ethoxy-3-nitro-phenyl)-5-methyl-7-propyl-1H-imidazo[5,1-f][1,2,4]triazin-4-one Openeye Name: 2-(2-ethoxy-3-nitro-phenyl)-5-methyl-7-propyl-1H-imidazo[5,1-f][1,2,4]triazin-4-one CAS Name: 2-(2-ethoxy-3-nitrophenyl)-5-methyl-7-propyl-1H-imidazo[5,1-f][1,2,4]triazin-4-one IUPAC Name: 2-(2-ethoxy-3-nitrophenyl)-5-methyl-7-propyl-1H-imidazo[5,1-f][1,2,4]triazin-4-one Traditional Name: 2-(2-ethoxy-3-nitro-phenyl)-5-methyl-7-propyl-1H-imidazo[5,1-f][1,2,4]triazin-4-one Formula: C17H19N5O4 MolecularWeight: 357.36386

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C2N1NC(=NC2=O)C3=C(C(=CC=C3)[N+](=O)[O-])OCC)C

Isomeric SMILES

CCCC1=NC(=C2N1NC(=NC2=O)C3=C(C(=CC=C3)[N+](=O)[O-])OCC)C

InChI

InChI=1S/C17H19N5O4/c1-4-7-13-18-10(3)14-17(23)19-16(20-21(13)14)11-8-6-9-12(22(24)25)15(11)26-5-2/h6,8-9H,4-5,7H2,1-3H3,(H,19,20,23)