methyl 9-bromanyl-11-oxidanylidene-6H-benzo[c][1]benzoxepine-2-carboxylate

Systemtic Name: methyl 9-bromanyl-11-oxidanylidene-6H-benzo[c][1]benzoxepine-2-carboxylate Openeye Name: methyl 9-bromo-11-oxo-6H-benzo[c][1]benzoxepine-2-carboxylate CAS Name: 9-bromo-11-oxo-6H-benzo[c][1]benzoxepin-2-carboxylic acid methyl ester IUPAC Name: methyl 9-bromo-11-oxo-6H-benzo[c][1]benzoxepine-2-carboxylate Traditional Name: 9-bromo-11-keto-6H-benzo[c][1]benzoxepin-2-carboxylic acid methyl ester Formula: C16H11BrO4 MolecularWeight: 347.16014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)OCC3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)OCC3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C16H11BrO4/c1-20-16(19)9-3-5-14-13(6-9)15(18)12-7-11(17)4-2-10(12)8-21-14/h2-7H,8H2,1H3