methyl 4-bromanyl-5,7-dihydrobenzo[d][2]benzoxepine-7-carboxylate

Systemtic Name: methyl 4-bromanyl-5,7-dihydrobenzo[d][2]benzoxepine-7-carboxylate Openeye Name: methyl 4-bromo-5,7-dihydrobenzo[d][2]benzoxepine-7-carboxylate CAS Name: 4-bromo-5,7-dihydrobenzo[d][2]benzoxepin-7-carboxylic acid methyl ester IUPAC Name: methyl 4-bromo-5,7-dihydrobenzo[d][2]benzoxepine-7-carboxylate Traditional Name: 4-bromo-5,7-dihydrobenzo[d][2]benzoxepin-7-carboxylic acid methyl ester Formula: C16H13BrO3 MolecularWeight: 333.17662

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C2=CC=CC=C2C3=C(CO1)C(=CC=C3)Br

Isomeric SMILES

COC(=O)C1C2=CC=CC=C2C3=C(CO1)C(=CC=C3)Br

InChI

InChI=1S/C16H13BrO3/c1-19-16(18)15-12-6-3-2-5-10(12)11-7-4-8-14(17)13(11)9-20-15/h2-8,15H,9H2,1H3