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

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-nitro-pyridin-2-amine Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-nitro-pyridin-2-amine CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-3-nitro-2-pyridinamine IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-3-nitropyridin-2-amine Traditional Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-(3-nitro-2-pyridyl)amine Formula: C17H17N5O2 MolecularWeight: 323.34918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC3=C(C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC3=C(C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O2/c1-12-15(11-19-17-16(22(23)24)9-6-10-18-17)13(2)21(20-12)14-7-4-3-5-8-14/h3-10H,11H2,1-2H3,(H,18,19)