[[(1E)-cyclodec-1-en-3,9-diyn-1-yl]-(2-ethylphenyl)methyl] 2-methoxyethanoate

Systemtic Name: [[(1E)-cyclodec-1-en-3,9-diyn-1-yl]-(2-ethylphenyl)methyl] 2-methoxyethanoate Openeye Name: [[(1E)-cyclodec-1-en-3,9-diyn-1-yl]-(2-ethylphenyl)methyl] 2-methoxyacetate CAS Name: 2-methoxyacetic acid [[(1E)-1-cyclodec-1-en-3,9-diynyl]-(2-ethylphenyl)methyl] ester IUPAC Name: [[(1E)-cyclodec-1-en-3,9-diyn-1-yl]-(2-ethylphenyl)methyl] 2-methoxyacetate Traditional Name: 2-methoxyacetic acid [[(1E)-cyclodec-1-en-3,9-diyn-1-yl]-(2-ethylphenyl)methyl] ester Formula: C22H24O3 MolecularWeight: 336.42416

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1C(C2=CC#CCCCCC#C2)OC(=O)COC

Isomeric SMILES

CCC1=CC=CC=C1C(/C/2=C/C#CCCCCC#C2)OC(=O)COC

InChI

InChI=1S/C22H24O3/c1-3-18-13-11-12-16-20(18)22(25-21(23)17-24-2)19-14-9-7-5-4-6-8-10-15-19/h11-13,15-16,22H,3-7,17H2,1-2H3/b19-15+