N-[(2-chloranyl-5-nitro-phenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine

Systemtic Name: N-[(2-chloranyl-5-nitro-phenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine Openeye Name: N-[(2-chloro-5-nitro-phenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine CAS Name: N-[(2-chloro-5-nitrophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine IUPAC Name: N-[(2-chloro-5-nitrophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine Traditional Name: (2-chloro-5-nitro-benzyl)-(3,5-dimethyl-1H-pyrazol-4-yl)amine Formula: C12H13ClN4O2 MolecularWeight: 280.71022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)NCC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C(=NN1)C)NCC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H13ClN4O2/c1-7-12(8(2)16-15-7)14-6-9-5-10(17(18)19)3-4-11(9)13/h3-5,14H,6H2,1-2H3,(H,15,16)