4-chloranyl-N-[4-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]-2-nitro-phenyl]benzamide

Systemtic Name: 4-chloranyl-N-[4-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]-2-nitro-phenyl]benzamide Openeye Name: 4-chloro-N-[4-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]-2-nitro-phenyl]benzamide CAS Name: 4-chloro-N-[4-[3-methyl-5-(trifluoromethyl)-1-pyrazolyl]-2-nitrophenyl]benzamide IUPAC Name: 4-chloro-N-[4-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]-2-nitrophenyl]benzamide Traditional Name: 4-chloro-N-[4-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]-2-nitro-phenyl]benzamide Formula: C18H12ClF3N4O3 MolecularWeight: 424.76109

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(F)(F)F)C2=CC(=C(C=C2)NC(=O)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=NN(C(=C1)C(F)(F)F)C2=CC(=C(C=C2)NC(=O)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H12ClF3N4O3/c1-10-8-16(18(20,21)22)25(24-10)13-6-7-14(15(9-13)26(28)29)23-17(27)11-2-4-12(19)5-3-11/h2-9H,1H3,(H,23,27)