3,5-dimethyl-N-[(4-methyl-3-nitro-phenyl)methyl]-1H-pyrazol-4-amine

Systemtic Name: 3,5-dimethyl-N-[(4-methyl-3-nitro-phenyl)methyl]-1H-pyrazol-4-amine Openeye Name: 3,5-dimethyl-N-[(4-methyl-3-nitro-phenyl)methyl]-1H-pyrazol-4-amine CAS Name: 3,5-dimethyl-N-[(4-methyl-3-nitrophenyl)methyl]-1H-pyrazol-4-amine IUPAC Name: 3,5-dimethyl-N-[(4-methyl-3-nitrophenyl)methyl]-1H-pyrazol-4-amine Traditional Name: (3,5-dimethyl-1H-pyrazol-4-yl)-(4-methyl-3-nitro-benzyl)amine Formula: C13H16N4O2 MolecularWeight: 260.29174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC2=C(NN=C2C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)CNC2=C(NN=C2C)C)[N+](=O)[O-]

InChI

InChI=1S/C13H16N4O2/c1-8-4-5-11(6-12(8)17(18)19)7-14-13-9(2)15-16-10(13)3/h4-6,14H,7H2,1-3H3,(H,15,16)