N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]-4-methyl-3-nitro-benzamide Openeye Name: N-[1-[(2-chloro-6-fluoro-phenyl)methyl]pyrazol-3-yl]-4-methyl-3-nitro-benzamide CAS Name: N-[1-[(2-chloro-6-fluorophenyl)methyl]-3-pyrazolyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[1-[(2-chloro-6-fluorophenyl)methyl]pyrazol-3-yl]-4-methyl-3-nitrobenzamide Traditional Name: N-[1-(2-chloro-6-fluoro-benzyl)pyrazol-3-yl]-4-methyl-3-nitro-benzamide Formula: C18H14ClFN4O3 MolecularWeight: 388.780163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=NN(C=C2)CC3=C(C=CC=C3Cl)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=NN(C=C2)CC3=C(C=CC=C3Cl)F)[N+](=O)[O-]

InChI

InChI=1S/C18H14ClFN4O3/c1-11-5-6-12(9-16(11)24(26)27)18(25)21-17-7-8-23(22-17)10-13-14(19)3-2-4-15(13)20/h2-9H,10H2,1H3,(H,21,22,25)