[6-[2-(2,2,4,4-tetramethyl-3H-chromen-6-yl)ethynyl]pyridin-3-yl] butanoate

Systemtic Name: [6-[2-(2,2,4,4-tetramethyl-3H-chromen-6-yl)ethynyl]pyridin-3-yl] butanoate Openeye Name: [6-[2-(2,2,4,4-tetramethylchroman-6-yl)ethynyl]-3-pyridyl] butanoate CAS Name: butanoic acid [6-[2-(2,2,4,4-tetramethyl-3,4-dihydro-2H-1-benzopyran-6-yl)ethynyl]-3-pyridinyl] ester IUPAC Name: [6-[2-(2,2,4,4-tetramethyl-3H-chromen-6-yl)ethynyl]pyridin-3-yl] butanoate Traditional Name: butyric acid [6-[2-(2,2,4,4-tetramethylchroman-6-yl)ethynyl]-3-pyridyl] ester Formula: C24H27NO3 MolecularWeight: 377.47608

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=CN=C(C=C1)C#CC2=CC3=C(C=C2)OC(CC3(C)C)(C)C

Isomeric SMILES

CCCC(=O)OC1=CN=C(C=C1)C#CC2=CC3=C(C=C2)OC(CC3(C)C)(C)C

InChI

InChI=1S/C24H27NO3/c1-6-7-22(26)27-19-12-11-18(25-15-19)10-8-17-9-13-21-20(14-17)23(2,3)16-24(4,5)28-21/h9,11-15H,6-7,16H2,1-5H3