N-[2,6-bis(bromanyl)-4-nitro-phenyl]-1-[(3,5-dimethylphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-[2,6-bis(bromanyl)-4-nitro-phenyl]-1-[(3,5-dimethylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(2,6-dibromo-4-nitro-phenyl)-1-[(3,5-dimethylphenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(2,6-dibromo-4-nitrophenyl)-1-[(3,5-dimethylphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(2,6-dibromo-4-nitrophenyl)-1-[(3,5-dimethylphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(2,6-dibromo-4-nitro-phenyl)-1-[(3,5-dimethylphenoxy)methyl]pyrazole-3-carboxamide Formula: C19H16Br2N4O4 MolecularWeight: 524.16274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCN2C=CC(=N2)C(=O)NC3=C(C=C(C=C3Br)[N+](=O)[O-])Br)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCN2C=CC(=N2)C(=O)NC3=C(C=C(C=C3Br)[N+](=O)[O-])Br)C

InChI

InChI=1S/C19H16Br2N4O4/c1-11-5-12(2)7-14(6-11)29-10-24-4-3-17(23-24)19(26)22-18-15(20)8-13(25(27)28)9-16(18)21/h3-9H,10H2,1-2H3,(H,22,26)