1-(5-bromanylpentyl)-1-(4-fluorophenyl)-7,8-dimethoxy-4,5-dihydro-3H-2-benzoxepine

Systemtic Name: 1-(5-bromanylpentyl)-1-(4-fluorophenyl)-7,8-dimethoxy-4,5-dihydro-3H-2-benzoxepine Openeye Name: 1-(5-bromopentyl)-1-(4-fluorophenyl)-7,8-dimethoxy-4,5-dihydro-3H-2-benzoxepine CAS Name: 1-(5-bromopentyl)-1-(4-fluorophenyl)-7,8-dimethoxy-4,5-dihydro-3H-2-benzoxepin IUPAC Name: 1-(5-bromopentyl)-1-(4-fluorophenyl)-7,8-dimethoxy-4,5-dihydro-3H-2-benzoxepine Traditional Name: 1-(5-bromopentyl)-1-(4-fluorophenyl)-7,8-dimethoxy-4,5-dihydro-3H-2-benzoxepin Formula: C23H28BrFO3 MolecularWeight: 451.369023

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCCOC2(CCCCCBr)C3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CCCOC2(CCCCCBr)C3=CC=C(C=C3)F)OC

InChI

InChI=1S/C23H28BrFO3/c1-26-21-15-17-7-6-14-28-23(12-4-3-5-13-24,20(17)16-22(21)27-2)18-8-10-19(25)11-9-18/h8-11,15-16H,3-7,12-14H2,1-2H3