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

Systemtic Name: 2-(4-bromanylpyrazol-1-yl)-N-[3-(4-methoxyphenoxy)-5-nitro-phenyl]propanamide Openeye Name: 2-(4-bromopyrazol-1-yl)-N-[3-(4-methoxyphenoxy)-5-nitro-phenyl]propanamide CAS Name: 2-(4-bromo-1-pyrazolyl)-N-[3-(4-methoxyphenoxy)-5-nitrophenyl]propanamide IUPAC Name: 2-(4-bromopyrazol-1-yl)-N-[3-(4-methoxyphenoxy)-5-nitrophenyl]propanamide Traditional Name: 2-(4-bromopyrazol-1-yl)-N-[3-(4-methoxyphenoxy)-5-nitro-phenyl]propionamide Formula: C19H17BrN4O5 MolecularWeight: 461.26608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC(=C1)OC2=CC=C(C=C2)OC)[N+](=O)[O-])N3C=C(C=N3)Br

Isomeric SMILES

CC(C(=O)NC1=CC(=CC(=C1)OC2=CC=C(C=C2)OC)[N+](=O)[O-])N3C=C(C=N3)Br

InChI

InChI=1S/C19H17BrN4O5/c1-12(23-11-13(20)10-21-23)19(25)22-14-7-15(24(26)27)9-18(8-14)29-17-5-3-16(28-2)4-6-17/h3-12H,1-2H3,(H,22,25)