6-(3-ethoxycarbonylphenyl)hex-5-ynoic acid

Systemtic Name: 6-(3-ethoxycarbonylphenyl)hex-5-ynoic acid Openeye Name: 6-(3-ethoxycarbonylphenyl)hex-5-ynoic acid CAS Name: 6-(3-ethoxycarbonylphenyl)-5-hexynoic acid IUPAC Name: 6-(3-ethoxycarbonylphenyl)hex-5-ynoic acid Traditional Name: 6-(3-carbethoxyphenyl)hex-5-ynoic acid Formula: C15H16O4 MolecularWeight: 260.28514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC(=C1)C#CCCCC(=O)O

Isomeric SMILES

CCOC(=O)C1=CC=CC(=C1)C#CCCCC(=O)O

InChI

InChI=1S/C15H16O4/c1-2-19-15(18)13-9-6-8-12(11-13)7-4-3-5-10-14(16)17/h6,8-9,11H,2-3,5,10H2,1H3,(H,16,17)