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

Systemtic Name: N-[2,6-bis(bromanyl)-4-nitro-phenyl]-1-[(4-methoxyphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(2,6-dibromo-4-nitro-phenyl)-1-[(4-methoxyphenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(2,6-dibromo-4-nitrophenyl)-1-[(4-methoxyphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(2,6-dibromo-4-nitrophenyl)-1-[(4-methoxyphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(2,6-dibromo-4-nitro-phenyl)-1-[(4-methoxyphenoxy)methyl]pyrazole-3-carboxamide Formula: C18H14Br2N4O5 MolecularWeight: 526.13556

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCN2C=CC(=N2)C(=O)NC3=C(C=C(C=C3Br)[N+](=O)[O-])Br

Isomeric SMILES

COC1=CC=C(C=C1)OCN2C=CC(=N2)C(=O)NC3=C(C=C(C=C3Br)[N+](=O)[O-])Br

InChI

InChI=1S/C18H14Br2N4O5/c1-28-12-2-4-13(5-3-12)29-10-23-7-6-16(22-23)18(25)21-17-14(19)8-11(24(26)27)9-15(17)20/h2-9H,10H2,1H3,(H,21,25)