3-iodanyl-1-[(1H-1,2,4-triazol-5-ylamino)methylidene]-6,7,8,9-tetrahydrodibenzofuran-2-one

Systemtic Name: 3-iodanyl-1-[(1H-1,2,4-triazol-5-ylamino)methylidene]-6,7,8,9-tetrahydrodibenzofuran-2-one Openeye Name: 3-iodo-1-[(1H-1,2,4-triazol-5-ylamino)methylene]-6,7,8,9-tetrahydrodibenzofuran-2-one CAS Name: 3-iodo-1-[(1H-1,2,4-triazol-5-ylamino)methylidene]-6,7,8,9-tetrahydrodibenzofuran-2-one IUPAC Name: 3-iodo-1-[(1H-1,2,4-triazol-5-ylamino)methylidene]-6,7,8,9-tetrahydrodibenzofuran-2-one Traditional Name: 3-iodo-1-[(1H-1,2,4-triazol-5-ylamino)methylene]-6,7,8,9-tetrahydrodibenzofuran-2-one Formula: C15H13IN4O2 MolecularWeight: 408.19379

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(O2)C=C(C(=O)C3=CNC4=NC=NN4)I

Isomeric SMILES

C1CCC2=C(C1)C3=C(O2)C=C(C(=O)C3=CNC4=NC=NN4)I

InChI

InChI=1S/C15H13IN4O2/c16-10-5-12-13(8-3-1-2-4-11(8)22-12)9(14(10)21)6-17-15-18-7-19-20-15/h5-7H,1-4H2,(H2,17,18,19,20)