(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2,4,6-trimethylbenzoate

Systemtic Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2,4,6-trimethylbenzoate Openeye Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2,4,6-trimethylbenzoate CAS Name: 2,4,6-trimethylbenzoic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2,4,6-trimethylbenzoate Traditional Name: 2,4,6-trimethylbenzoic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C19H19NO6 MolecularWeight: 357.35726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19NO6/c1-11-4-12(2)17(13(3)5-11)19(21)25-9-15-7-16(20(22)23)6-14-8-24-10-26-18(14)15/h4-7H,8-10H2,1-3H3