2-(5-bromanylpentoxy)-3,6,7,10,11-pentabutoxy-triphenylene

Systemtic Name: 2-(5-bromanylpentoxy)-3,6,7,10,11-pentabutoxy-triphenylene Openeye Name: 2-(5-bromopentoxy)-3,6,7,10,11-pentabutoxy-triphenylene CAS Name: 2-(5-bromopentoxy)-3,6,7,10,11-pentabutoxytriphenylene IUPAC Name: 2-(5-bromopentoxy)-3,6,7,10,11-pentabutoxytriphenylene Traditional Name: 2-(5-bromopentoxy)-3,6,7,10,11-pentabutoxy-triphenylene Formula: C43H61BrO6 MolecularWeight: 753.84484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)OCCCC)OCCCCCBr)OCCCC)OCCCC)OCCCC

Isomeric SMILES

CCCCOC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)OCCCC)OCCCCCBr)OCCCC)OCCCC)OCCCC

InChI

InChI=1S/C43H61BrO6/c1-6-11-20-45-38-26-32-33-27-39(46-21-12-7-2)41(48-23-14-9-4)29-35(33)37-31-43(50-25-18-16-17-19-44)42(49-24-15-10-5)30-36(37)34(32)28-40(38)47-22-13-8-3/h26-31H,6-25H2,1-5H3