(Z)-2-azanyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]but-2-enedinitrile

Systemtic Name: (Z)-2-azanyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]but-2-enedinitrile Openeye Name: (Z)-2-amino-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]but-2-enedinitrile CAS Name: (Z)-2-amino-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-butenedinitrile IUPAC Name: (Z)-2-amino-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]but-2-enedinitrile Traditional Name: (Z)-2-amino-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]but-2-enedinitrile Formula: C12H7N5O4 MolecularWeight: 285.21508

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=NC(=C(C#N)N)C#N)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)C=N/C(=C(/C#N)\N)/C#N)[N+](=O)[O-]

InChI

InChI=1S/C12H7N5O4/c13-3-8(15)9(4-14)16-5-7-1-11-12(21-6-20-11)2-10(7)17(18)19/h1-2,5H,6,15H2/b9-8-,16-5?