(6-bromanyl-1,3-benzodioxol-5-yl)methyl 4-nitrobenzoate

Systemtic Name: (6-bromanyl-1,3-benzodioxol-5-yl)methyl 4-nitrobenzoate Openeye Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester Formula: C15H10BrNO6 MolecularWeight: 380.147

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)COC(=O)C3=CC=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)COC(=O)C3=CC=C(C=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C15H10BrNO6/c16-12-6-14-13(22-8-23-14)5-10(12)7-21-15(18)9-1-3-11(4-2-9)17(19)20/h1-6H,7-8H2