1-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-(1,3-thiazol-2-yl)methanimine

Systemtic Name: 1-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-(1,3-thiazol-2-yl)methanimine Openeye Name: 1-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-thiazol-2-yl-methanimine CAS Name: 1-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-(2-thiazolyl)methanimine IUPAC Name: 1-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-(1,3-thiazol-2-yl)methanimine Traditional Name: (E)-(6-nitro-4H-1,3-benzodioxin-8-yl)methylene-thiazol-2-yl-amine Formula: C12H9N3O4S MolecularWeight: 291.28256

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C(=CC(=C2)[N+](=O)[O-])C=NC3=NC=CS3)OCO1

Isomeric SMILES

C1C2=C(C(=CC(=C2)[N+](=O)[O-])/C=N/C3=NC=CS3)OCO1

InChI

InChI=1S/C12H9N3O4S/c16-15(17)10-3-8(5-14-12-13-1-2-20-12)11-9(4-10)6-18-7-19-11/h1-5H,6-7H2/b14-5+