12-(phenylcarbonyloxy)dodeca-1,11-diynyl benzoate

Systemtic Name: 12-(phenylcarbonyloxy)dodeca-1,11-diynyl benzoate Openeye Name: 12-benzoyloxydodeca-1,11-diynyl benzoate CAS Name: benzoic acid 12-benzoyloxydodeca-1,11-diynyl ester IUPAC Name: 12-benzoyloxydodeca-1,11-diynyl benzoate Traditional Name: benzoic acid 12-benzoyloxydodeca-1,11-diynyl ester Formula: C26H26O4 MolecularWeight: 402.48224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC#CCCCCCCCCC#COC(=O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC#CCCCCCCCCC#COC(=O)C2=CC=CC=C2

InChI

InChI=1S/C26H26O4/c27-25(23-17-11-9-12-18-23)29-21-15-7-5-3-1-2-4-6-8-16-22-30-26(28)24-19-13-10-14-20-24/h9-14,17-20H,1-8H2