N-[(E)-(2-nitro-5-oxidanyl-phenyl)methylideneamino]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(E)-(2-nitro-5-oxidanyl-phenyl)methylideneamino]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(E)-(5-hydroxy-2-nitro-phenyl)methyleneamino]-1,3-benzodioxole-5-carboxamide CAS Name: N-[(E)-(5-hydroxy-2-nitrophenyl)methylideneamino]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(E)-(5-hydroxy-2-nitrophenyl)methylideneamino]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(E)-(5-hydroxy-2-nitro-benzylidene)amino]-piperonylamide Formula: C15H11N3O6 MolecularWeight: 329.26434

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NN=CC3=C(C=CC(=C3)O)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C15H11N3O6/c19-11-2-3-12(18(21)22)10(5-11)7-16-17-15(20)9-1-4-13-14(6-9)24-8-23-13/h1-7,19H,8H2,(H,17,20)/b16-7+