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

Systemtic Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 3-oxidanylnaphthalene-2-carboxylate Openeye Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 3-hydroxynaphthalene-2-carboxylate CAS Name: 3-hydroxy-2-naphthalenecarboxylic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 3-hydroxynaphthalene-2-carboxylate Traditional Name: 3-hydroxynaphthalene-2-carboxylic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C20H15NO7 MolecularWeight: 381.3356

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)COC(=O)C3=CC4=CC=CC=C4C=C3O)[N+](=O)[O-]

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)COC(=O)C3=CC4=CC=CC=C4C=C3O)[N+](=O)[O-]

InChI

InChI=1S/C20H15NO7/c22-18-8-13-4-2-1-3-12(13)7-17(18)20(23)27-10-15-6-16(21(24)25)5-14-9-26-11-28-19(14)15/h1-8,22H,9-11H2