6-bromanyl-3-(6-nitro-1H-benzimidazol-2-yl)chromen-2-one

Systemtic Name: 6-bromanyl-3-(6-nitro-1H-benzimidazol-2-yl)chromen-2-one Openeye Name: 6-bromo-3-(6-nitro-1H-benzimidazol-2-yl)chromen-2-one CAS Name: 6-bromo-3-(6-nitro-1H-benzimidazol-2-yl)-1-benzopyran-2-one IUPAC Name: 6-bromo-3-(6-nitro-1H-benzimidazol-2-yl)chromen-2-one Traditional Name: 6-bromo-3-(6-nitro-1H-benzimidazol-2-yl)coumarin Formula: C16H8BrN3O4 MolecularWeight: 386.15642

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])NC(=N2)C3=CC4=C(C=CC(=C4)Br)OC3=O

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])NC(=N2)C3=CC4=C(C=CC(=C4)Br)OC3=O

InChI

InChI=1S/C16H8BrN3O4/c17-9-1-4-14-8(5-9)6-11(16(21)24-14)15-18-12-3-2-10(20(22)23)7-13(12)19-15/h1-7H,(H,18,19)