methyl 4-bromanyl-5H-benzo[d][1,3]benzodioxocine-11-carboxylate

Systemtic Name: methyl 4-bromanyl-5H-benzo[d][1,3]benzodioxocine-11-carboxylate Openeye Name: methyl 4-bromo-5H-benzo[d][1,3]benzodioxocine-11-carboxylate CAS Name: 4-bromo-5H-benzo[d][1,3]benzodioxocin-11-carboxylic acid methyl ester IUPAC Name: methyl 4-bromo-5H-benzo[d][1,3]benzodioxocine-11-carboxylate Traditional Name: 4-bromo-5H-benzo[d][1,3]benzodioxocin-11-carboxylic acid methyl ester Formula: C16H13BrO4 MolecularWeight: 349.17602

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1OC2=C(CC3=CC=CC=C3O1)C(=CC=C2)Br

Isomeric SMILES

COC(=O)C1OC2=C(CC3=CC=CC=C3O1)C(=CC=C2)Br

InChI

InChI=1S/C16H13BrO4/c1-19-15(18)16-20-13-7-3-2-5-10(13)9-11-12(17)6-4-8-14(11)21-16/h2-8,16H,9H2,1H3