4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]-N-phenethyl-benzamide

Systemtic Name: 4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]-N-phenethyl-benzamide Openeye Name: 4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]-N-phenethyl-benzamide CAS Name: 4-[(5-methyl-3-nitro-1-pyrazolyl)methyl]-N-phenethylbenzamide IUPAC Name: 4-[(5-methyl-3-nitropyrazol-1-yl)methyl]-N-phenethylbenzamide Traditional Name: 4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]-N-phenethyl-benzamide Formula: C20H20N4O3 MolecularWeight: 364.3978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=CC=C(C=C2)C(=O)NCCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1CC2=CC=C(C=C2)C(=O)NCCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O3/c1-15-13-19(24(26)27)22-23(15)14-17-7-9-18(10-8-17)20(25)21-12-11-16-5-3-2-4-6-16/h2-10,13H,11-12,14H2,1H3,(H,21,25)