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

Systemtic Name: 3-(4-bromanylpyrazol-1-yl)-N-[3-(4-chloranylphenoxy)-5-nitro-phenyl]propanamide Openeye Name: 3-(4-bromopyrazol-1-yl)-N-[3-(4-chlorophenoxy)-5-nitro-phenyl]propanamide CAS Name: 3-(4-bromo-1-pyrazolyl)-N-[3-(4-chlorophenoxy)-5-nitrophenyl]propanamide IUPAC Name: 3-(4-bromopyrazol-1-yl)-N-[3-(4-chlorophenoxy)-5-nitrophenyl]propanamide Traditional Name: 3-(4-bromopyrazol-1-yl)-N-[3-(4-chlorophenoxy)-5-nitro-phenyl]propionamide Formula: C18H14BrClN4O4 MolecularWeight: 465.68516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CCN3C=C(C=N3)Br)Cl

Isomeric SMILES

C1=CC(=CC=C1OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CCN3C=C(C=N3)Br)Cl

InChI

InChI=1S/C18H14BrClN4O4/c19-12-10-21-23(11-12)6-5-18(25)22-14-7-15(24(26)27)9-17(8-14)28-16-3-1-13(20)2-4-16/h1-4,7-11H,5-6H2,(H,22,25)