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

Systemtic Name: ethyl 5-[5-[2-(4,4-diethyl-2,3-dihydrochromen-6-yl)ethynyl]furan-2-yl]pentanoate Openeye Name: ethyl 5-[5-[2-(4,4-diethylchroman-6-yl)ethynyl]-2-furyl]pentanoate CAS Name: 5-[5-[2-(4,4-diethyl-3,4-dihydro-2H-1-benzopyran-6-yl)ethynyl]-2-furanyl]pentanoic acid ethyl ester IUPAC Name: ethyl 5-[5-[2-(4,4-diethyl-2,3-dihydrochromen-6-yl)ethynyl]furan-2-yl]pentanoate Traditional Name: 5-[5-[2-(4,4-diethylchroman-6-yl)ethynyl]-2-furyl]valeric acid ethyl ester Formula: C26H32O4 MolecularWeight: 408.52988

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCOC2=C1C=C(C=C2)C#CC3=CC=C(O3)CCCCC(=O)OCC)CC

Isomeric SMILES

CCC1(CCOC2=C1C=C(C=C2)C#CC3=CC=C(O3)CCCCC(=O)OCC)CC

InChI

InChI=1S/C26H32O4/c1-4-26(5-2)17-18-29-24-16-12-20(19-23(24)26)11-13-22-15-14-21(30-22)9-7-8-10-25(27)28-6-3/h12,14-16,19H,4-10,17-18H2,1-3H3