hex-1-yn-3-yl 2-(5-chloranylquinolin-8-yl)oxyethanoate

Systemtic Name: hex-1-yn-3-yl 2-(5-chloranylquinolin-8-yl)oxyethanoate Openeye Name: 1-ethynylbutyl 2-[(5-chloro-8-quinolyl)oxy]acetate CAS Name: 2-[(5-chloro-8-quinolinyl)oxy]acetic acid hex-1-yn-3-yl ester IUPAC Name: hex-1-yn-3-yl 2-(5-chloroquinolin-8-yl)oxyacetate Traditional Name: 2-[(5-chloro-8-quinolyl)oxy]acetic acid 1-propylprop-2-ynyl ester Formula: C17H16ClNO3 MolecularWeight: 317.76684

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C#C)OC(=O)COC1=C2C(=C(C=C1)Cl)C=CC=N2

Isomeric SMILES

CCCC(C#C)OC(=O)COC1=C2C(=C(C=C1)Cl)C=CC=N2

InChI

InChI=1S/C17H16ClNO3/c1-3-6-12(4-2)22-16(20)11-21-15-9-8-14(18)13-7-5-10-19-17(13)15/h2,5,7-10,12H,3,6,11H2,1H3