2-morpholin-4-ium-4-yl-N-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]ethanamide

Systemtic Name: 2-morpholin-4-ium-4-yl-N-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]ethanamide Openeye Name: 2-morpholin-4-ium-4-yl-N-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]acetamide CAS Name: 2-(4-morpholin-4-iumyl)-N-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]acetamide IUPAC Name: 2-morpholin-4-ium-4-yl-N-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]acetamide Traditional Name: 2-morpholin-4-ium-4-yl-N-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]acetamide Formula: C14H17N4O6+ MolecularWeight: 337.30798

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(=O)NN=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3

Isomeric SMILES

C1COCC[NH+]1CC(=O)N/N=C\C2=CC3=C(C=C2[N+](=O)[O-])OCO3

InChI

InChI=1S/C14H16N4O6/c19-14(8-17-1-3-22-4-2-17)16-15-7-10-5-12-13(24-9-23-12)6-11(10)18(20)21/h5-7H,1-4,8-9H2,(H,16,19)/p+1/b15-7-