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

Systemtic Name: [[(1E)-cyclodec-1-en-3,9-diyn-1-yl]-[2-(hydroxymethyl)phenyl]methyl] 2-methoxyethanoate Openeye Name: [[(1E)-cyclodec-1-en-3,9-diyn-1-yl]-[2-(hydroxymethyl)phenyl]methyl] 2-methoxyacetate CAS Name: 2-methoxyacetic acid [[(1E)-1-cyclodec-1-en-3,9-diynyl]-[2-(hydroxymethyl)phenyl]methyl] ester IUPAC Name: [[(1E)-cyclodec-1-en-3,9-diyn-1-yl]-[2-(hydroxymethyl)phenyl]methyl] 2-methoxyacetate Traditional Name: 2-methoxyacetic acid [[(1E)-cyclodec-1-en-3,9-diyn-1-yl]-(2-methylolphenyl)methyl] ester Formula: C21H22O4 MolecularWeight: 338.39698

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)OC(C1=CC=CC=C1CO)C2=CC#CCCCCC#C2

Isomeric SMILES

COCC(=O)OC(C1=CC=CC=C1CO)/C/2=C/C#CCCCCC#C2

InChI

InChI=1S/C21H22O4/c1-24-16-20(23)25-21(19-14-10-9-13-18(19)15-22)17-11-7-5-3-2-4-6-8-12-17/h9-10,12-14,21-22H,2-5,15-16H2,1H3/b17-12+