6-nitro-2-(1,2,4-triazol-4-yl)benzo[de]isoquinoline-1,3-dione

Systemtic Name: 6-nitro-2-(1,2,4-triazol-4-yl)benzo[de]isoquinoline-1,3-dione Openeye Name: 6-nitro-2-(1,2,4-triazol-4-yl)benzo[de]isoquinoline-1,3-dione CAS Name: 6-nitro-2-(1,2,4-triazol-4-yl)benzo[de]isoquinoline-1,3-dione IUPAC Name: 6-nitro-2-(1,2,4-triazol-4-yl)benzo[de]isoquinoline-1,3-dione Traditional Name: 6-nitro-2-(1,2,4-triazol-4-yl)benzo[de]isoquinoline-1,3-quinone Formula: C14H7N5O4 MolecularWeight: 309.23648

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC3=C2C(=C1)C(=O)N(C3=O)N4C=NN=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=CC3=C2C(=C1)C(=O)N(C3=O)N4C=NN=C4)[N+](=O)[O-]

InChI

InChI=1S/C14H7N5O4/c20-13-9-3-1-2-8-11(19(22)23)5-4-10(12(8)9)14(21)18(13)17-6-15-16-7-17/h1-7H