3-(4-bromanylpyrazol-1-yl)-N-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-2-methyl-propanamide

Systemtic Name: 3-(4-bromanylpyrazol-1-yl)-N-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-2-methyl-propanamide Openeye Name: 3-(4-bromopyrazol-1-yl)-N-[3-(4-chlorophenoxy)-5-nitro-phenyl]-2-methyl-propanamide CAS Name: 3-(4-bromo-1-pyrazolyl)-N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-methylpropanamide IUPAC Name: 3-(4-bromopyrazol-1-yl)-N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-methylpropanamide Traditional Name: 3-(4-bromopyrazol-1-yl)-N-[3-(4-chlorophenoxy)-5-nitro-phenyl]-2-methyl-propionamide Formula: C19H16BrClN4O4 MolecularWeight: 479.71174

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=C(C=N1)Br)C(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(CN1C=C(C=N1)Br)C(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H16BrClN4O4/c1-12(10-24-11-13(20)9-22-24)19(26)23-15-6-16(25(27)28)8-18(7-15)29-17-4-2-14(21)3-5-17/h2-9,11-12H,10H2,1H3,(H,23,26)