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

Systemtic Name: ethyl 6-[2-(2,2,4,4-tetramethyl-3H-chromen-7-yl)ethynyl]pyridine-3-carboxylate Openeye Name: ethyl 6-[2-(2,2,4,4-tetramethylchroman-7-yl)ethynyl]pyridine-3-carboxylate CAS Name: 6-[2-(2,2,4,4-tetramethyl-3,4-dihydro-2H-1-benzopyran-7-yl)ethynyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[2-(2,2,4,4-tetramethyl-3H-chromen-7-yl)ethynyl]pyridine-3-carboxylate Traditional Name: 6-[2-(2,2,4,4-tetramethylchroman-7-yl)ethynyl]nicotinic acid ethyl ester Formula: C23H25NO3 MolecularWeight: 363.4495

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(C=C1)C#CC2=CC3=C(C=C2)C(CC(O3)(C)C)(C)C

Isomeric SMILES

CCOC(=O)C1=CN=C(C=C1)C#CC2=CC3=C(C=C2)C(CC(O3)(C)C)(C)C

InChI

InChI=1S/C23H25NO3/c1-6-26-21(25)17-9-11-18(24-14-17)10-7-16-8-12-19-20(13-16)27-23(4,5)15-22(19,2)3/h8-9,11-14H,6,15H2,1-5H3