ethyl 6-[2-(2,2,3,3,4-pentamethyl-4H-chromen-6-yl)ethynyl]pyridine-3-carboxylate

Systemtic Name: ethyl 6-[2-(2,2,3,3,4-pentamethyl-4H-chromen-6-yl)ethynyl]pyridine-3-carboxylate Openeye Name: ethyl 6-[2-(2,2,3,3,4-pentamethylchroman-6-yl)ethynyl]pyridine-3-carboxylate CAS Name: 6-[2-(2,2,3,3,4-pentamethyl-3,4-dihydro-2H-1-benzopyran-6-yl)ethynyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[2-(2,2,3,3,4-pentamethyl-4H-chromen-6-yl)ethynyl]pyridine-3-carboxylate Traditional Name: 6-[2-(2,2,3,3,4-pentamethylchroman-6-yl)ethynyl]nicotinic acid ethyl ester Formula: C24H27NO3 MolecularWeight: 377.47608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(C=C1)C#CC2=CC3=C(C=C2)OC(C(C3C)(C)C)(C)C

Isomeric SMILES

CCOC(=O)C1=CN=C(C=C1)C#CC2=CC3=C(C=C2)OC(C(C3C)(C)C)(C)C

InChI

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