3-[(2-methyl-4-nitro-phenyl)amino]-2H-1,2,4-triazin-5-one

Systemtic Name: 3-[(2-methyl-4-nitro-phenyl)amino]-2H-1,2,4-triazin-5-one Openeye Name: 3-(2-methyl-4-nitro-anilino)-2H-1,2,4-triazin-5-one CAS Name: 3-(2-methyl-4-nitroanilino)-2H-1,2,4-triazin-5-one IUPAC Name: 3-(2-methyl-4-nitroanilino)-2H-1,2,4-triazin-5-one Traditional Name: 3-(2-methyl-4-nitro-anilino)-2H-1,2,4-triazin-5-one Formula: C10H9N5O3 MolecularWeight: 247.21016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC2=NC(=O)C=NN2

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC2=NC(=O)C=NN2

InChI

InChI=1S/C10H9N5O3/c1-6-4-7(15(17)18)2-3-8(6)12-10-13-9(16)5-11-14-10/h2-5H,1H3,(H2,12,13,14,16)