1-[4-(4-dodecoxy-3-penta-1,3-diynyl-phenyl)buta-1,3-diynyl]-4,5-dimethyl-2-(undecoxymethyl)benzene

Systemtic Name: 1-[4-(4-dodecoxy-3-penta-1,3-diynyl-phenyl)buta-1,3-diynyl]-4,5-dimethyl-2-(undecoxymethyl)benzene Openeye Name: 1-[4-(4-dodecoxy-3-penta-1,3-diynyl-phenyl)buta-1,3-diynyl]-4,5-dimethyl-2-(undecoxymethyl)benzene CAS Name: 1-[4-(4-dodecoxy-3-penta-1,3-diynylphenyl)buta-1,3-diynyl]-4,5-dimethyl-2-(undecoxymethyl)benzene IUPAC Name: 1-[4-(4-dodecoxy-3-penta-1,3-diynylphenyl)buta-1,3-diynyl]-4,5-dimethyl-2-(undecoxymethyl)benzene Traditional Name: 1-[4-(4-lauryloxy-3-penta-1,3-diynyl-phenyl)buta-1,3-diynyl]-4,5-dimethyl-2-(undecoxymethyl)benzene Formula: C47H64O2 MolecularWeight: 661.00986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C(C=C(C=C1)C#CC#CC2=CC(=C(C=C2COCCCCCCCCCCC)C)C)C#CC#CC

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C=C1)C#CC#CC2=CC(=C(C=C2COCCCCCCCCCCC)C)C)C#CC#CC

InChI

InChI=1S/C47H64O2/c1-6-9-12-14-16-18-20-22-24-29-36-49-47-34-33-43(39-45(47)32-25-11-8-3)30-26-27-31-44-37-41(4)42(5)38-46(44)40-48-35-28-23-21-19-17-15-13-10-7-2/h33-34,37-39H,6-7,9-10,12-24,28-29,35-36,40H2,1-5H3