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

Systemtic Name: N-[2,6-bis(bromanyl)-4-nitro-phenyl]-1-(phenoxymethyl)pyrazole-3-carboxamide Openeye Name: N-(2,6-dibromo-4-nitro-phenyl)-1-(phenoxymethyl)pyrazole-3-carboxamide CAS Name: N-(2,6-dibromo-4-nitrophenyl)-1-(phenoxymethyl)-3-pyrazolecarboxamide IUPAC Name: N-(2,6-dibromo-4-nitrophenyl)-1-(phenoxymethyl)pyrazole-3-carboxamide Traditional Name: N-(2,6-dibromo-4-nitro-phenyl)-1-(phenoxymethyl)pyrazole-3-carboxamide Formula: C17H12Br2N4O4 MolecularWeight: 496.10958

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCN2C=CC(=N2)C(=O)NC3=C(C=C(C=C3Br)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC=C(C=C1)OCN2C=CC(=N2)C(=O)NC3=C(C=C(C=C3Br)[N+](=O)[O-])Br

InChI

InChI=1S/C17H12Br2N4O4/c18-13-8-11(23(25)26)9-14(19)16(13)20-17(24)15-6-7-22(21-15)10-27-12-4-2-1-3-5-12/h1-9H,10H2,(H,20,24)