1-[(2-bromanyl-4-chloranyl-phenoxy)methyl]-N-(4-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: 1-[(2-bromanyl-4-chloranyl-phenoxy)methyl]-N-(4-nitrophenyl)pyrazole-3-carboxamide Openeye Name: 1-[(2-bromo-4-chloro-phenoxy)methyl]-N-(4-nitrophenyl)pyrazole-3-carboxamide CAS Name: 1-[(2-bromo-4-chlorophenoxy)methyl]-N-(4-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(2-bromo-4-chlorophenoxy)methyl]-N-(4-nitrophenyl)pyrazole-3-carboxamide Traditional Name: 1-[(2-bromo-4-chloro-phenoxy)methyl]-N-(4-nitrophenyl)pyrazole-3-carboxamide Formula: C17H12BrClN4O4 MolecularWeight: 451.65858

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C2=NN(C=C2)COC3=C(C=C(C=C3)Cl)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)C2=NN(C=C2)COC3=C(C=C(C=C3)Cl)Br)[N+](=O)[O-]

InChI

InChI=1S/C17H12BrClN4O4/c18-14-9-11(19)1-6-16(14)27-10-22-8-7-15(21-22)17(24)20-12-2-4-13(5-3-12)23(25)26/h1-9H,10H2,(H,20,24)