N-hexyl-6-nitro-1,3-benzodioxol-5-amine

Systemtic Name: N-hexyl-6-nitro-1,3-benzodioxol-5-amine Openeye Name: N-hexyl-6-nitro-1,3-benzodioxol-5-amine CAS Name: N-hexyl-6-nitro-1,3-benzodioxol-5-amine IUPAC Name: N-hexyl-6-nitro-1,3-benzodioxol-5-amine Traditional Name: hexyl-(6-nitro-1,3-benzodioxol-5-yl)amine Formula: C13H18N2O4 MolecularWeight: 266.29302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC1=CC2=C(C=C1[N+](=O)[O-])OCO2

Isomeric SMILES

CCCCCCNC1=CC2=C(C=C1[N+](=O)[O-])OCO2

InChI

InChI=1S/C13H18N2O4/c1-2-3-4-5-6-14-10-7-12-13(19-9-18-12)8-11(10)15(16)17/h7-8,14H,2-6,9H2,1H3