2-(1,3-benzodioxol-5-yl)-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]ethanamide

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]ethanamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-[(E)-(5-nitro-2-furyl)methyleneamino]acetamide CAS Name: 2-(1,3-benzodioxol-5-yl)-N-[(E)-(5-nitro-2-furanyl)methylideneamino]acetamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]acetamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-N-[(E)-(5-nitro-2-furyl)methyleneamino]acetamide Formula: C14H11N3O6 MolecularWeight: 317.25364

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CC(=O)NN=CC3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CC(=O)N/N=C/C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C14H11N3O6/c18-13(6-9-1-3-11-12(5-9)22-8-21-11)16-15-7-10-2-4-14(23-10)17(19)20/h1-5,7H,6,8H2,(H,16,18)/b15-7+