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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C(C)N3C=C(C=N3)Br)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C(C)N3C=C(C=N3)Br)Cl

InChI

InChI=1S/C19H16BrClN4O4/c1-11-5-16(3-4-18(11)21)29-17-7-14(6-15(8-17)25(27)28)23-19(26)12(2)24-10-13(20)9-22-24/h3-10,12H,1-2H3,(H,23,26)