4-nitro-N,1-bis(phenylmethyl)pyrazol-3-amine

Systemtic Name: 4-nitro-N,1-bis(phenylmethyl)pyrazol-3-amine Openeye Name: N,1-dibenzyl-4-nitro-pyrazol-3-amine CAS Name: 4-nitro-N,1-bis(phenylmethyl)-3-pyrazolamine IUPAC Name: N,1-dibenzyl-4-nitropyrazol-3-amine Traditional Name: benzyl-(1-benzyl-4-nitro-pyrazol-3-yl)amine Formula: C17H16N4O2 MolecularWeight: 308.33454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NN(C=C2[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NN(C=C2[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C17H16N4O2/c22-21(23)16-13-20(12-15-9-5-2-6-10-15)19-17(16)18-11-14-7-3-1-4-8-14/h1-10,13H,11-12H2,(H,18,19)