methyl 6-(3-methoxyphenyl)hex-5-ynoate

Systemtic Name: methyl 6-(3-methoxyphenyl)hex-5-ynoate Openeye Name: methyl 6-(3-methoxyphenyl)hex-5-ynoate CAS Name: 6-(3-methoxyphenyl)-5-hexynoic acid methyl ester IUPAC Name: methyl 6-(3-methoxyphenyl)hex-5-ynoate Traditional Name: 6-(3-methoxyphenyl)hex-5-ynoic acid methyl ester Formula: C14H16O3 MolecularWeight: 232.27504

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C#CCCCC(=O)OC

Isomeric SMILES

COC1=CC=CC(=C1)C#CCCCC(=O)OC

InChI

InChI=1S/C14H16O3/c1-16-13-9-6-8-12(11-13)7-4-3-5-10-14(15)17-2/h6,8-9,11H,3,5,10H2,1-2H3