2-(4-bromanylpyrazol-1-yl)-N-[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]ethanamide

Systemtic Name: 2-(4-bromanylpyrazol-1-yl)-N-[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]ethanamide Openeye Name: 2-(4-bromopyrazol-1-yl)-N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]acetamide CAS Name: 2-(4-bromo-1-pyrazolyl)-N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]acetamide IUPAC Name: 2-(4-bromopyrazol-1-yl)-N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]acetamide Traditional Name: 2-(4-bromopyrazol-1-yl)-N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]acetamide Formula: C18H14BrClN4O4 MolecularWeight: 465.68516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CN3C=C(C=N3)Br)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CN3C=C(C=N3)Br)Cl

InChI

InChI=1S/C18H14BrClN4O4/c1-11-4-15(2-3-17(11)20)28-16-6-13(5-14(7-16)24(26)27)22-18(25)10-23-9-12(19)8-21-23/h2-9H,10H2,1H3,(H,22,25)