N-[2-(3-bromanyl-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[2-(3-bromanyl-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-5-nitro-furan-2-carboxamide Openeye Name: N-[2-(3-bromo-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-5-nitro-furan-2-carboxamide CAS Name: N-[2-(3-bromo-4-methylphenyl)-1,3-benzoxazol-5-yl]-5-nitro-2-furancarboxamide IUPAC Name: N-[2-(3-bromo-4-methylphenyl)-1,3-benzoxazol-5-yl]-5-nitrofuran-2-carboxamide Traditional Name: N-[2-(3-bromo-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-5-nitro-2-furamide Formula: C19H12BrN3O5 MolecularWeight: 442.21968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=CC=C(O4)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=CC=C(O4)[N+](=O)[O-])Br

InChI

InChI=1S/C19H12BrN3O5/c1-10-2-3-11(8-13(10)20)19-22-14-9-12(4-5-15(14)28-19)21-18(24)16-6-7-17(27-16)23(25)26/h2-9H,1H3,(H,21,24)