4-nitro-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]aniline

Systemtic Name: 4-nitro-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]aniline Openeye Name: 4-nitro-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]aniline CAS Name: 4-nitro-N-[(1,3,5-trimethyl-4-pyrazolyl)methyl]aniline IUPAC Name: 4-nitro-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]aniline Traditional Name: (4-nitrophenyl)-[(1,3,5-trimethylpyrazol-4-yl)methyl]amine Formula: C13H16N4O2 MolecularWeight: 260.29174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)CNC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C)C)CNC2=CC=C(C=C2)[N+](=O)[O-]

InChI

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