ethyl 5-[2-[2-[3-(tert-butylamino)-2-oxidanyl-propoxy]phenyl]ethynyl]furan-2-carboxylate

Systemtic Name: ethyl 5-[2-[2-[3-(tert-butylamino)-2-oxidanyl-propoxy]phenyl]ethynyl]furan-2-carboxylate Openeye Name: ethyl 5-[2-[2-[3-(tert-butylamino)-2-hydroxy-propoxy]phenyl]ethynyl]furan-2-carboxylate CAS Name: 5-[2-[2-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]ethynyl]-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-[2-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]ethynyl]furan-2-carboxylate Traditional Name: 5-[2-[2-[3-(tert-butylamino)-2-hydroxy-propoxy]phenyl]ethynyl]furan-2-carboxylic acid ethyl ester Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(O1)C#CC2=CC=CC=C2OCC(CNC(C)(C)C)O

Isomeric SMILES

CCOC(=O)C1=CC=C(O1)C#CC2=CC=CC=C2OCC(CNC(C)(C)C)O

InChI

InChI=1S/C22H27NO5/c1-5-26-21(25)20-13-12-18(28-20)11-10-16-8-6-7-9-19(16)27-15-17(24)14-23-22(2,3)4/h6-9,12-13,17,23-24H,5,14-15H2,1-4H3