2-(4-bromanyl-5-methyl-pyrazol-1-yl)-N-[3-(3-methylphenoxy)-5-nitro-phenyl]ethanamide

Systemtic Name: 2-(4-bromanyl-5-methyl-pyrazol-1-yl)-N-[3-(3-methylphenoxy)-5-nitro-phenyl]ethanamide Openeye Name: 2-(4-bromo-5-methyl-pyrazol-1-yl)-N-[3-(3-methylphenoxy)-5-nitro-phenyl]acetamide CAS Name: 2-(4-bromo-5-methyl-1-pyrazolyl)-N-[3-(3-methylphenoxy)-5-nitrophenyl]acetamide IUPAC Name: 2-(4-bromo-5-methylpyrazol-1-yl)-N-[3-(3-methylphenoxy)-5-nitrophenyl]acetamide Traditional Name: 2-(4-bromo-5-methyl-pyrazol-1-yl)-N-[3-(3-methylphenoxy)-5-nitro-phenyl]acetamide Formula: C19H17BrN4O4 MolecularWeight: 445.26668

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17BrN4O4/c1-12-4-3-5-16(6-12)28-17-8-14(7-15(9-17)24(26)27)22-19(25)11-23-13(2)18(20)10-21-23/h3-10H,11H2,1-2H3,(H,22,25)