3-azanyl-5-[3-[(2-cyano-4-nitro-phenyl)-methyl-amino]propyl]-1H-pyrazole-4-carbonitrile

Systemtic Name: 3-azanyl-5-[3-[(2-cyano-4-nitro-phenyl)-methyl-amino]propyl]-1H-pyrazole-4-carbonitrile Openeye Name: 3-amino-5-[3-(2-cyano-N-methyl-4-nitro-anilino)propyl]-1H-pyrazole-4-carbonitrile CAS Name: 3-amino-5-[3-(2-cyano-N-methyl-4-nitroanilino)propyl]-1H-pyrazole-4-carbonitrile IUPAC Name: 3-amino-5-[3-(2-cyano-N-methyl-4-nitroanilino)propyl]-1H-pyrazole-4-carbonitrile Traditional Name: 3-amino-5-[3-(2-cyano-N-methyl-4-nitro-anilino)propyl]-1H-pyrazole-4-carbonitrile Formula: C15H15N7O2 MolecularWeight: 325.3253

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC1=C(C(=NN1)N)C#N)C2=C(C=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

CN(CCCC1=C(C(=NN1)N)C#N)C2=C(C=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C15H15N7O2/c1-21(6-2-3-13-12(9-17)15(18)20-19-13)14-5-4-11(22(23)24)7-10(14)8-16/h4-5,7H,2-3,6H2,1H3,(H3,18,19,20)