[1-(2-oxidanyl-5-oxidanylidene-2H-furan-3-yl)-6-pyridin-2-yl-hex-5-ynyl] ethanoate

Systemtic Name: [1-(2-oxidanyl-5-oxidanylidene-2H-furan-3-yl)-6-pyridin-2-yl-hex-5-ynyl] ethanoate Openeye Name: [1-(2-hydroxy-5-oxo-2H-furan-3-yl)-6-(2-pyridyl)hex-5-ynyl] acetate CAS Name: acetic acid [1-(2-hydroxy-5-oxo-2H-furan-3-yl)-6-(2-pyridinyl)hex-5-ynyl] ester IUPAC Name: [1-(2-hydroxy-5-oxo-2H-furan-3-yl)-6-pyridin-2-ylhex-5-ynyl] acetate Traditional Name: acetic acid [1-(2-hydroxy-5-keto-2H-furan-3-yl)-6-(2-pyridyl)hex-5-ynyl] ester Formula: C17H17NO5 MolecularWeight: 315.32058

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CCCC#CC1=CC=CC=N1)C2=CC(=O)OC2O

Isomeric SMILES

CC(=O)OC(CCCC#CC1=CC=CC=N1)C2=CC(=O)OC2O

InChI

InChI=1S/C17H17NO5/c1-12(19)22-15(14-11-16(20)23-17(14)21)9-4-2-3-7-13-8-5-6-10-18-13/h5-6,8,10-11,15,17,21H,2,4,9H2,1H3