1,1'-biphenyl; 3-dodecylheptadecanoate

Systemtic Name: 1,1'-biphenyl; 3-dodecylheptadecanoate Openeye Name: biphenyl; 3-dodecylheptadecanoate CAS Name: 1,1'-biphenyl; 3-dodecylheptadecanoate IUPAC Name: 1,1'-biphenyl; 3-dodecylheptadecanoate Traditional Name: biphenyl; 3-laurylheptadecanoate Formula: C41H67O2- MolecularWeight: 591.96948

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(CCCCCCCCCCCC)CC(=O)[O-].C1=CC=C(C=C1)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCC(CCCCCCCCCCCC)CC(=O)[O-].C1=CC=C(C=C1)C2=CC=CC=C2

InChI

InChI=1S/C29H58O2.C12H10/c1-3-5-7-9-11-13-15-16-18-20-22-24-26-28(27-29(30)31)25-23-21-19-17-14-12-10-8-6-4-2;1-3-7-11(8-4-1)12-9-5-2-6-10-12/h28H,3-27H2,1-2H3,(H,30,31);1-10H/p-1