N-[2,6-bis(bromanyl)-4-nitro-phenyl]-1-[(4-bromanylphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-[2,6-bis(bromanyl)-4-nitro-phenyl]-1-[(4-bromanylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: 1-[(4-bromophenoxy)methyl]-N-(2,6-dibromo-4-nitro-phenyl)pyrazole-3-carboxamide CAS Name: 1-[(4-bromophenoxy)methyl]-N-(2,6-dibromo-4-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromophenoxy)methyl]-N-(2,6-dibromo-4-nitrophenyl)pyrazole-3-carboxamide Traditional Name: 1-[(4-bromophenoxy)methyl]-N-(2,6-dibromo-4-nitro-phenyl)pyrazole-3-carboxamide Formula: C17H11Br3N4O4 MolecularWeight: 575.00564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCN2C=CC(=N2)C(=O)NC3=C(C=C(C=C3Br)[N+](=O)[O-])Br)Br

Isomeric SMILES

C1=CC(=CC=C1OCN2C=CC(=N2)C(=O)NC3=C(C=C(C=C3Br)[N+](=O)[O-])Br)Br

InChI

InChI=1S/C17H11Br3N4O4/c18-10-1-3-12(4-2-10)28-9-23-6-5-15(22-23)17(25)21-16-13(19)7-11(24(26)27)8-14(16)20/h1-8H,9H2,(H,21,25)