ethyl 3-[2-(5-ethoxycarbonyl-2-methyl-phenyl)ethynyl]-4-methyl-benzoate

Systemtic Name: ethyl 3-[2-(5-ethoxycarbonyl-2-methyl-phenyl)ethynyl]-4-methyl-benzoate Openeye Name: ethyl 3-[2-(5-ethoxycarbonyl-2-methyl-phenyl)ethynyl]-4-methyl-benzoate CAS Name: 3-[2-(5-ethoxycarbonyl-2-methylphenyl)ethynyl]-4-methylbenzoic acid ethyl ester IUPAC Name: ethyl 3-[2-(5-ethoxycarbonyl-2-methylphenyl)ethynyl]-4-methylbenzoate Traditional Name: 3-[2-(5-carbethoxy-2-methyl-phenyl)ethynyl]-4-methyl-benzoic acid ethyl ester Formula: C22H22O4 MolecularWeight: 350.40768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22O4/c1-5-25-21(23)19-9-7-15(3)17(13-19)11-12-18-14-20(10-8-16(18)4)22(24)26-6-2/h7-10,13-14H,5-6H2,1-4H3