4-bromanyl-1,5-dimethyl-N-[3-(3-methylphenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-1,5-dimethyl-N-[3-(3-methylphenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide Openeye Name: 4-bromo-1,5-dimethyl-N-[3-(3-methylphenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide CAS Name: 4-bromo-1,5-dimethyl-N-[3-(3-methylphenoxy)-5-nitrophenyl]-3-pyrazolecarboxamide IUPAC Name: 4-bromo-1,5-dimethyl-N-[3-(3-methylphenoxy)-5-nitrophenyl]pyrazole-3-carboxamide Traditional Name: 4-bromo-1,5-dimethyl-N-[3-(3-methylphenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide Formula: C19H17BrN4O4 MolecularWeight: 445.26668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NN(C(=C3Br)C)C

Isomeric SMILES

CC1=CC(=CC=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NN(C(=C3Br)C)C

InChI

InChI=1S/C19H17BrN4O4/c1-11-5-4-6-15(7-11)28-16-9-13(8-14(10-16)24(26)27)21-19(25)18-17(20)12(2)23(3)22-18/h4-10H,1-3H3,(H,21,25)