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

Systemtic Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 4-oxidanylbenzoate Openeye Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 4-hydroxybenzoate CAS Name: 4-hydroxybenzoic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 4-hydroxybenzoate Traditional Name: 4-hydroxybenzoic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C16H13NO7 MolecularWeight: 331.27692

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)COC(=O)C3=CC=C(C=C3)O)[N+](=O)[O-]

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)COC(=O)C3=CC=C(C=C3)O)[N+](=O)[O-]

InChI

InChI=1S/C16H13NO7/c18-14-3-1-10(2-4-14)16(19)23-8-12-6-13(17(20)21)5-11-7-22-9-24-15(11)12/h1-6,18H,7-9H2