2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-oxidanylidene-7,8-dihydro-6H-quinoline-3-carbonitrile

Systemtic Name: 2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-oxidanylidene-7,8-dihydro-6H-quinoline-3-carbonitrile Openeye Name: 2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-oxo-7,8-dihydro-6H-quinoline-3-carbonitrile CAS Name: 2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylthio]-5-oxo-7,8-dihydro-6H-quinoline-3-carbonitrile IUPAC Name: 2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-oxo-7,8-dihydro-6H-quinoline-3-carbonitrile Traditional Name: 5-keto-2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylthio]-7,8-dihydro-6H-quinoline-3-carbonitrile Formula: C19H15N3O5S MolecularWeight: 397.4045

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C(C(=N2)SCC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4)C#N)C(=O)C1

Isomeric SMILES

C1CC2=C(C=C(C(=N2)SCC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4)C#N)C(=O)C1

InChI

InChI=1S/C19H15N3O5S/c20-7-11-6-15-16(2-1-3-17(15)23)21-19(11)28-9-13-5-14(22(24)25)4-12-8-26-10-27-18(12)13/h4-6H,1-3,8-10H2