ethyl 5-[2-(4,4-dimethyl-2,3-dihydrochromen-6-yl)ethynyl]furan-2-carboxylate

Systemtic Name: ethyl 5-[2-(4,4-dimethyl-2,3-dihydrochromen-6-yl)ethynyl]furan-2-carboxylate Openeye Name: ethyl 5-[2-(4,4-dimethylchroman-6-yl)ethynyl]furan-2-carboxylate CAS Name: 5-[2-(4,4-dimethyl-3,4-dihydro-2H-1-benzopyran-6-yl)ethynyl]-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(4,4-dimethyl-2,3-dihydrochromen-6-yl)ethynyl]furan-2-carboxylate Traditional Name: 5-[2-(4,4-dimethylchroman-6-yl)ethynyl]furan-2-carboxylic acid ethyl ester Formula: C20H20O4 MolecularWeight: 324.3704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(O1)C#CC2=CC3=C(C=C2)OCCC3(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(O1)C#CC2=CC3=C(C=C2)OCCC3(C)C

InChI

InChI=1S/C20H20O4/c1-4-22-19(21)18-10-8-15(24-18)7-5-14-6-9-17-16(13-14)20(2,3)11-12-23-17/h6,8-10,13H,4,11-12H2,1-3H3