3,9-bis(bromanyl)-5,5,7,7-tetraoctyl-benzo[d][2]benzoxepine

Systemtic Name: 3,9-bis(bromanyl)-5,5,7,7-tetraoctyl-benzo[d][2]benzoxepine Openeye Name: 3,9-dibromo-5,5,7,7-tetraoctyl-benzo[d][2]benzoxepine CAS Name: 3,9-dibromo-5,5,7,7-tetraoctylbenzo[d][2]benzoxepin IUPAC Name: 3,9-dibromo-5,5,7,7-tetraoctylbenzo[d][2]benzoxepine Traditional Name: 3,9-dibromo-5,5,7,7-tetraoctyl-benzo[d][2]benzoxepin Formula: C46H74Br2O MolecularWeight: 802.88716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1(C2=C(C=CC(=C2)Br)C3=C(C=C(C=C3)Br)C(O1)(CCCCCCCC)CCCCCCCC)CCCCCCCC

Isomeric SMILES

CCCCCCCCC1(C2=C(C=CC(=C2)Br)C3=C(C=C(C=C3)Br)C(O1)(CCCCCCCC)CCCCCCCC)CCCCCCCC

InChI

InChI=1S/C46H74Br2O/c1-5-9-13-17-21-25-33-45(34-26-22-18-14-10-6-2)43-37-39(47)29-31-41(43)42-32-30-40(48)38-44(42)46(49-45,35-27-23-19-15-11-7-3)36-28-24-20-16-12-8-4/h29-32,37-38H,5-28,33-36H2,1-4H3