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

Systemtic Name: N-[2,6-bis(bromanyl)-4-nitro-phenyl]-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(2,6-dibromo-4-nitro-phenyl)-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(2,6-dibromo-4-nitrophenyl)-1-[(2-methylphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(2,6-dibromo-4-nitrophenyl)-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(2,6-dibromo-4-nitro-phenyl)-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide Formula: C18H14Br2N4O4 MolecularWeight: 510.13616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCN2C=CC(=N2)C(=O)NC3=C(C=C(C=C3Br)[N+](=O)[O-])Br

Isomeric SMILES

CC1=CC=CC=C1OCN2C=CC(=N2)C(=O)NC3=C(C=C(C=C3Br)[N+](=O)[O-])Br

InChI

InChI=1S/C18H14Br2N4O4/c1-11-4-2-3-5-16(11)28-10-23-7-6-15(22-23)18(25)21-17-13(19)8-12(24(26)27)9-14(17)20/h2-9H,10H2,1H3,(H,21,25)