4-methoxy-6-morpholin-4-yl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1,3,5-triazin-2-amine

Systemtic Name: 4-methoxy-6-morpholin-4-yl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1,3,5-triazin-2-amine Openeye Name: 4-methoxy-6-morpholino-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-1,3,5-triazin-2-amine CAS Name: 4-methoxy-6-(4-morpholinyl)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1,3,5-triazin-2-amine IUPAC Name: 4-methoxy-6-morpholin-4-yl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1,3,5-triazin-2-amine Traditional Name: (4-methoxy-6-morpholino-s-triazin-2-yl)-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]amine Formula: C16H17N7O6 MolecularWeight: 403.34948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=N1)NN=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3)N4CCOCC4

Isomeric SMILES

COC1=NC(=NC(=N1)N/N=C/C2=CC3=C(C=C2[N+](=O)[O-])OCO3)N4CCOCC4

InChI

InChI=1S/C16H17N7O6/c1-26-16-19-14(18-15(20-16)22-2-4-27-5-3-22)21-17-8-10-6-12-13(29-9-28-12)7-11(10)23(24)25/h6-8H,2-5,9H2,1H3,(H,18,19,20,21)/b17-8+