[6-[2-(7-ethyl-2,2,4,4-tetramethyl-3H-chromen-6-yl)ethynyl]pyridin-3-yl] butanoate

Systemtic Name: [6-[2-(7-ethyl-2,2,4,4-tetramethyl-3H-chromen-6-yl)ethynyl]pyridin-3-yl] butanoate Openeye Name: [6-[2-(7-ethyl-2,2,4,4-tetramethyl-chroman-6-yl)ethynyl]-3-pyridyl] butanoate CAS Name: butanoic acid [6-[2-(7-ethyl-2,2,4,4-tetramethyl-3,4-dihydro-2H-1-benzopyran-6-yl)ethynyl]-3-pyridinyl] ester IUPAC Name: [6-[2-(7-ethyl-2,2,4,4-tetramethyl-3H-chromen-6-yl)ethynyl]pyridin-3-yl] butanoate Traditional Name: butyric acid [6-[2-(7-ethyl-2,2,4,4-tetramethyl-chroman-6-yl)ethynyl]-3-pyridyl] ester Formula: C26H31NO3 MolecularWeight: 405.52924

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=CN=C(C=C1)C#CC2=CC3=C(C=C2CC)OC(CC3(C)C)(C)C

Isomeric SMILES

CCCC(=O)OC1=CN=C(C=C1)C#CC2=CC3=C(C=C2CC)OC(CC3(C)C)(C)C

InChI

InChI=1S/C26H31NO3/c1-7-9-24(28)29-21-13-12-20(27-16-21)11-10-19-14-22-23(15-18(19)8-2)30-26(5,6)17-25(22,3)4/h12-16H,7-9,17H2,1-6H3