N-(2-bromanyl-4-methyl-phenyl)-2-(2-methoxyethylamino)-5-nitro-benzamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-2-(2-methoxyethylamino)-5-nitro-benzamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-2-(2-methoxyethylamino)-5-nitro-benzamide CAS Name: N-(2-bromo-4-methylphenyl)-2-(2-methoxyethylamino)-5-nitrobenzamide IUPAC Name: N-(2-bromo-4-methylphenyl)-2-(2-methoxyethylamino)-5-nitrobenzamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-2-(2-methoxyethylamino)-5-nitro-benzamide Formula: C17H18BrN3O4 MolecularWeight: 408.24652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCCOC)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCCOC)Br

InChI

InChI=1S/C17H18BrN3O4/c1-11-3-5-16(14(18)9-11)20-17(22)13-10-12(21(23)24)4-6-15(13)19-7-8-25-2/h3-6,9-10,19H,7-8H2,1-2H3,(H,20,22)