1-[2-(1-acetyloxynon-2-ynyl)phenyl]non-2-ynyl ethanoate

Systemtic Name: 1-[2-(1-acetyloxynon-2-ynyl)phenyl]non-2-ynyl ethanoate Openeye Name: 1-[2-(1-acetoxynon-2-ynyl)phenyl]non-2-ynyl acetate CAS Name: acetic acid 1-[2-(1-acetyloxynon-2-ynyl)phenyl]non-2-ynyl ester IUPAC Name: 1-[2-(1-acetyloxynon-2-ynyl)phenyl]non-2-ynyl acetate Traditional Name: acetic acid 1-[2-(1-acetoxynon-2-ynyl)phenyl]non-2-ynyl ester Formula: C28H38O4 MolecularWeight: 438.59892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC(C1=CC=CC=C1C(C#CCCCCCC)OC(=O)C)OC(=O)C

Isomeric SMILES

CCCCCCC#CC(C1=CC=CC=C1C(C#CCCCCCC)OC(=O)C)OC(=O)C

InChI

InChI=1S/C28H38O4/c1-5-7-9-11-13-15-21-27(31-23(3)29)25-19-17-18-20-26(25)28(32-24(4)30)22-16-14-12-10-8-6-2/h17-20,27-28H,5-14H2,1-4H3