3-nitro-1-(1H-1,2,4-triazol-5-yliminomethyl)-6,7,8,9-tetrahydrodibenzofuran-2-olate

Systemtic Name: 3-nitro-1-(1H-1,2,4-triazol-5-yliminomethyl)-6,7,8,9-tetrahydrodibenzofuran-2-olate Openeye Name: 3-nitro-1-(1H-1,2,4-triazol-5-yliminomethyl)-6,7,8,9-tetrahydrodibenzofuran-2-olate CAS Name: 3-nitro-1-(1H-1,2,4-triazol-5-yliminomethyl)-6,7,8,9-tetrahydrodibenzofuran-2-olate IUPAC Name: 3-nitro-1-(1H-1,2,4-triazol-5-yliminomethyl)-6,7,8,9-tetrahydrodibenzofuran-2-olate Traditional Name: 3-nitro-1-(1H-1,2,4-triazol-5-yliminomethyl)-6,7,8,9-tetrahydrodibenzofuran-2-olate Formula: C15H12N5O4- MolecularWeight: 326.28688

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(O2)C=C(C(=C3C=NC4=NC=NN4)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCC2=C(C1)C3=C(O2)C=C(C(=C3C=NC4=NC=NN4)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H13N5O4/c21-14-9(6-16-15-17-7-18-19-15)13-8-3-1-2-4-11(8)24-12(13)5-10(14)20(22)23/h5-7,21H,1-4H2,(H,17,18,19)/p-1