1-[4-(4-dodecoxyphenyl)buta-1,3-diynyl]-4-nitro-benzene

Systemtic Name: 1-[4-(4-dodecoxyphenyl)buta-1,3-diynyl]-4-nitro-benzene Openeye Name: 1-[4-(4-dodecoxyphenyl)buta-1,3-diynyl]-4-nitro-benzene CAS Name: 1-[4-(4-dodecoxyphenyl)buta-1,3-diynyl]-4-nitrobenzene IUPAC Name: 1-[4-(4-dodecoxyphenyl)buta-1,3-diynyl]-4-nitrobenzene Traditional Name: 1-[4-(4-lauryloxyphenyl)buta-1,3-diynyl]-4-nitro-benzene Formula: C28H33NO3 MolecularWeight: 431.56652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)C#CC#CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)C#CC#CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C28H33NO3/c1-2-3-4-5-6-7-8-9-10-13-24-32-28-22-18-26(19-23-28)15-12-11-14-25-16-20-27(21-17-25)29(30)31/h16-23H,2-10,13,24H2,1H3