5,8-dinitro-2-(1,3,4-thiadiazol-2-yl)benzo[de]isoquinoline-1,3-dione

Systemtic Name: 5,8-dinitro-2-(1,3,4-thiadiazol-2-yl)benzo[de]isoquinoline-1,3-dione Openeye Name: 5,8-dinitro-2-(1,3,4-thiadiazol-2-yl)benzo[de]isoquinoline-1,3-dione CAS Name: 5,8-dinitro-2-(1,3,4-thiadiazol-2-yl)benzo[de]isoquinoline-1,3-dione IUPAC Name: 5,8-dinitro-2-(1,3,4-thiadiazol-2-yl)benzo[de]isoquinoline-1,3-dione Traditional Name: 5,8-dinitro-2-(1,3,4-thiadiazol-2-yl)benzo[de]isoquinoline-1,3-quinone Formula: C14H5N5O6S MolecularWeight: 371.2844

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C=C(C=C3C2=C(C=C1[N+](=O)[O-])C(=O)N(C3=O)C4=NN=CS4)[N+](=O)[O-]

Isomeric SMILES

C1=C2C=C(C=C3C2=C(C=C1[N+](=O)[O-])C(=O)N(C3=O)C4=NN=CS4)[N+](=O)[O-]

InChI

InChI=1S/C14H5N5O6S/c20-12-9-3-7(18(22)23)1-6-2-8(19(24)25)4-10(11(6)9)13(21)17(12)14-16-15-5-26-14/h1-5H