1-[(4-bromanylphenoxy)methyl]-N-[3-(4-methoxyphenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide

Systemtic Name: 1-[(4-bromanylphenoxy)methyl]-N-[3-(4-methoxyphenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide Openeye Name: 1-[(4-bromophenoxy)methyl]-N-[3-(4-methoxyphenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide CAS Name: 1-[(4-bromophenoxy)methyl]-N-[3-(4-methoxyphenoxy)-5-nitrophenyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromophenoxy)methyl]-N-[3-(4-methoxyphenoxy)-5-nitrophenyl]pyrazole-3-carboxamide Traditional Name: 1-[(4-bromophenoxy)methyl]-N-[3-(4-methoxyphenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide Formula: C24H19BrN4O6 MolecularWeight: 539.33486

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NN(C=C3)COC4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC=C(C=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NN(C=C3)COC4=CC=C(C=C4)Br

InChI

InChI=1S/C24H19BrN4O6/c1-33-19-6-8-21(9-7-19)35-22-13-17(12-18(14-22)29(31)32)26-24(30)23-10-11-28(27-23)15-34-20-4-2-16(25)3-5-20/h2-14H,15H2,1H3,(H,26,30)