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

Systemtic Name: N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-nitro-aniline Openeye Name: N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-nitro-aniline CAS Name: N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-nitroaniline IUPAC Name: N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-nitroaniline Traditional Name: (3,5-dimethyl-1H-pyrazol-4-yl)methyl-(4-nitrophenyl)amine Formula: C12H14N4O2 MolecularWeight: 246.26516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)CNC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1)C)CNC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H14N4O2/c1-8-12(9(2)15-14-8)7-13-10-3-5-11(6-4-10)16(17)18/h3-6,13H,7H2,1-2H3,(H,14,15)