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

Systemtic Name: 1-[(4-bromanylphenoxy)methyl]-N-[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide Openeye Name: 1-[(4-bromophenoxy)methyl]-N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide CAS Name: 1-[(4-bromophenoxy)methyl]-N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromophenoxy)methyl]-N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]pyrazole-3-carboxamide Traditional Name: 1-[(4-bromophenoxy)methyl]-N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide Formula: C24H18BrClN4O5 MolecularWeight: 557.78052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NN(C=C3)COC4=CC=C(C=C4)Br)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NN(C=C3)COC4=CC=C(C=C4)Br)Cl

InChI

InChI=1S/C24H18BrClN4O5/c1-15-10-20(6-7-22(15)26)35-21-12-17(11-18(13-21)30(32)33)27-24(31)23-8-9-29(28-23)14-34-19-4-2-16(25)3-5-19/h2-13H,14H2,1H3,(H,27,31)