N-(2-bromanyl-4-methyl-phenyl)-5-nitro-1-benzofuran-3-carboxamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-5-nitro-1-benzofuran-3-carboxamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-5-nitro-benzofuran-3-carboxamide CAS Name: N-(2-bromo-4-methylphenyl)-5-nitro-3-benzofurancarboxamide IUPAC Name: N-(2-bromo-4-methylphenyl)-5-nitro-1-benzofuran-3-carboxamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-5-nitro-benzofuran-3-carboxamide Formula: C16H11BrN2O4 MolecularWeight: 375.17354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=COC3=C2C=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=COC3=C2C=C(C=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C16H11BrN2O4/c1-9-2-4-14(13(17)6-9)18-16(20)12-8-23-15-5-3-10(19(21)22)7-11(12)15/h2-8H,1H3,(H,18,20)