tert-butyl N-[1-[1-(4-methoxybutyl)-6-oxidanylidene-2,3-dihydropyridin-5-yl]-8-oxidanyl-oct-3-yn-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-[1-(4-methoxybutyl)-6-oxidanylidene-2,3-dihydropyridin-5-yl]-8-oxidanyl-oct-3-yn-2-yl]carbamate Openeye Name: tert-butyl N-[7-hydroxy-1-[[1-(4-methoxybutyl)-6-oxo-2,3-dihydropyridin-5-yl]methyl]hept-2-ynyl]carbamate CAS Name: N-[8-hydroxy-1-[1-(4-methoxybutyl)-6-oxo-2,3-dihydropyridin-5-yl]oct-3-yn-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[8-hydroxy-1-[1-(4-methoxybutyl)-6-oxo-2,3-dihydropyridin-5-yl]oct-3-yn-2-yl]carbamate Traditional Name: N-[7-hydroxy-1-[[6-keto-1-(4-methoxybutyl)-2,3-dihydropyridin-5-yl]methyl]hept-2-ynyl]carbamic acid tert-butyl ester Formula: C23H38N2O5 MolecularWeight: 422.55822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CCCN(C1=O)CCCCOC)C#CCCCCO

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CCCN(C1=O)CCCCOC)C#CCCCCO

InChI

InChI=1S/C23H38N2O5/c1-23(2,3)30-22(28)24-20(13-7-5-6-9-16-26)18-19-12-11-15-25(21(19)27)14-8-10-17-29-4/h12,20,26H,5-6,8-11,14-18H2,1-4H3,(H,24,28)