(6-bromanyl-1,3-benzodioxol-5-yl)methyl 2-(4-nitrophenoxy)ethanoate

Systemtic Name: (6-bromanyl-1,3-benzodioxol-5-yl)methyl 2-(4-nitrophenoxy)ethanoate Openeye Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 2-(4-nitrophenoxy)acetate CAS Name: 2-(4-nitrophenoxy)acetic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 2-(4-nitrophenoxy)acetate Traditional Name: 2-(4-nitrophenoxy)acetic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester Formula: C16H12BrNO7 MolecularWeight: 410.17298

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)COC(=O)COC3=CC=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)COC(=O)COC3=CC=C(C=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C16H12BrNO7/c17-13-6-15-14(24-9-25-15)5-10(13)7-23-16(19)8-22-12-3-1-11(2-4-12)18(20)21/h1-6H,7-9H2