methyl 2-(2-tridec-1-ynylphenyl)ethanoate

Systemtic Name: methyl 2-(2-tridec-1-ynylphenyl)ethanoate Openeye Name: methyl 2-(2-tridec-1-ynylphenyl)acetate CAS Name: 2-(2-tridec-1-ynylphenyl)acetic acid methyl ester IUPAC Name: methyl 2-(2-tridec-1-ynylphenyl)acetate Traditional Name: 2-(2-tridec-1-ynylphenyl)acetic acid methyl ester Formula: C22H32O2 MolecularWeight: 328.48828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC#CC1=CC=CC=C1CC(=O)OC

Isomeric SMILES

CCCCCCCCCCCC#CC1=CC=CC=C1CC(=O)OC

InChI

InChI=1S/C22H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-16-20-17-14-15-18-21(20)19-22(23)24-2/h14-15,17-18H,3-12,19H2,1-2H3