ethyl 2-[2-(3-hydroxyphenyl)ethynyl]-6-methyl-benzoate

Systemtic Name: ethyl 2-[2-(3-hydroxyphenyl)ethynyl]-6-methyl-benzoate Openeye Name: ethyl 2-[2-(3-hydroxyphenyl)ethynyl]-6-methyl-benzoate CAS Name: 2-[2-(3-hydroxyphenyl)ethynyl]-6-methylbenzoic acid ethyl ester IUPAC Name: ethyl 2-[2-(3-hydroxyphenyl)ethynyl]-6-methylbenzoate Traditional Name: 2-[2-(3-hydroxyphenyl)ethynyl]-6-methyl-benzoic acid ethyl ester Formula: C18H16O3 MolecularWeight: 280.31784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC=C1C)C#CC2=CC(=CC=C2)O

Isomeric SMILES

CCOC(=O)C1=C(C=CC=C1C)C#CC2=CC(=CC=C2)O

InChI

InChI=1S/C18H16O3/c1-3-21-18(20)17-13(2)6-4-8-15(17)11-10-14-7-5-9-16(19)12-14/h4-9,12,19H,3H2,1-2H3