methyl 2-(3-pent-1-ynylphenyl)ethanoate

Systemtic Name: methyl 2-(3-pent-1-ynylphenyl)ethanoate Openeye Name: methyl 2-(3-pent-1-ynylphenyl)acetate CAS Name: 2-(3-pent-1-ynylphenyl)acetic acid methyl ester IUPAC Name: methyl 2-(3-pent-1-ynylphenyl)acetate Traditional Name: 2-(3-pent-1-ynylphenyl)acetic acid methyl ester Formula: C14H16O2 MolecularWeight: 216.27564

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Descriptors Computed from Structure

Canonical SMILES:

CCCC#CC1=CC(=CC=C1)CC(=O)OC

Isomeric SMILES

CCCC#CC1=CC(=CC=C1)CC(=O)OC

InChI

InChI=1S/C14H16O2/c1-3-4-5-7-12-8-6-9-13(10-12)11-14(15)16-2/h6,8-10H,3-4,11H2,1-2H3