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

Systemtic Name: 8-[(4-methylphenoxy)methyl]-6-nitro-4H-1,3-benzodioxine Openeye Name: 8-[(4-methylphenoxy)methyl]-6-nitro-4H-1,3-benzodioxine CAS Name: 8-[(4-methylphenoxy)methyl]-6-nitro-4H-1,3-benzodioxin IUPAC Name: 8-[(4-methylphenoxy)methyl]-6-nitro-4H-1,3-benzodioxine Traditional Name: 8-[(4-methylphenoxy)methyl]-6-nitro-4H-1,3-benzodioxin Formula: C16H15NO5 MolecularWeight: 301.294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

Isomeric SMILES

CC1=CC=C(C=C1)OCC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

InChI

InChI=1S/C16H15NO5/c1-11-2-4-15(5-3-11)21-9-13-7-14(17(18)19)6-12-8-20-10-22-16(12)13/h2-7H,8-10H2,1H3