N-morpholin-4-yl-1-(6-nitro-1,3-benzodioxol-5-yl)methanimine

Systemtic Name: N-morpholin-4-yl-1-(6-nitro-1,3-benzodioxol-5-yl)methanimine Openeye Name: N-morpholino-1-(6-nitro-1,3-benzodioxol-5-yl)methanimine CAS Name: N-(4-morpholinyl)-1-(6-nitro-1,3-benzodioxol-5-yl)methanimine IUPAC Name: N-morpholin-4-yl-1-(6-nitro-1,3-benzodioxol-5-yl)methanimine Traditional Name: (E)-morpholino-[(6-nitro-1,3-benzodioxol-5-yl)methylene]amine Formula: C12H13N3O5 MolecularWeight: 279.24872

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1N=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3

Isomeric SMILES

C1COCCN1/N=C/C2=CC3=C(C=C2[N+](=O)[O-])OCO3

InChI

InChI=1S/C12H13N3O5/c16-15(17)10-6-12-11(19-8-20-12)5-9(10)7-13-14-1-3-18-4-2-14/h5-7H,1-4,8H2/b13-7+