N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]-2-nitro-benzamide

Systemtic Name: N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]-2-nitro-benzamide Openeye Name: N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]-2-nitro-benzamide CAS Name: N-[3-(3-methyl-1-phenyl-4-pyrazolyl)propyl]-2-nitrobenzamide IUPAC Name: N-[3-(3-methyl-1-phenylpyrazol-4-yl)propyl]-2-nitrobenzamide Traditional Name: N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]-2-nitro-benzamide Formula: C20H20N4O3 MolecularWeight: 364.3978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1CCCNC(=O)C2=CC=CC=C2[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C=C1CCCNC(=O)C2=CC=CC=C2[N+](=O)[O-])C3=CC=CC=C3

InChI

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