8-[(4-tert-butylphenoxy)methyl]-6-nitro-4H-1,3-benzodioxine

Systemtic Name: 8-[(4-tert-butylphenoxy)methyl]-6-nitro-4H-1,3-benzodioxine Openeye Name: 8-[(4-tert-butylphenoxy)methyl]-6-nitro-4H-1,3-benzodioxine CAS Name: 8-[(4-tert-butylphenoxy)methyl]-6-nitro-4H-1,3-benzodioxin IUPAC Name: 8-[(4-tert-butylphenoxy)methyl]-6-nitro-4H-1,3-benzodioxine Traditional Name: 8-[(4-tert-butylphenoxy)methyl]-6-nitro-4H-1,3-benzodioxin Formula: C19H21NO5 MolecularWeight: 343.37374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

InChI

InChI=1S/C19H21NO5/c1-19(2,3)15-4-6-17(7-5-15)24-11-14-9-16(20(21)22)8-13-10-23-12-25-18(13)14/h4-9H,10-12H2,1-3H3