[3-ethyl-2-(1-oxidanylnon-2-ynyl)quinolin-4-yl] ethanoate

Systemtic Name: [3-ethyl-2-(1-oxidanylnon-2-ynyl)quinolin-4-yl] ethanoate Openeye Name: [3-ethyl-2-(1-hydroxynon-2-ynyl)-4-quinolyl] acetate CAS Name: acetic acid [3-ethyl-2-(1-hydroxynon-2-ynyl)-4-quinolinyl] ester IUPAC Name: [3-ethyl-2-(1-hydroxynon-2-ynyl)quinolin-4-yl] acetate Traditional Name: acetic acid [3-ethyl-2-(1-hydroxynon-2-ynyl)-4-quinolyl] ester Formula: C22H27NO3 MolecularWeight: 353.45468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC(C1=NC2=CC=CC=C2C(=C1CC)OC(=O)C)O

Isomeric SMILES

CCCCCCC#CC(C1=NC2=CC=CC=C2C(=C1CC)OC(=O)C)O

InChI

InChI=1S/C22H27NO3/c1-4-6-7-8-9-10-15-20(25)21-17(5-2)22(26-16(3)24)18-13-11-12-14-19(18)23-21/h11-14,20,25H,4-9H2,1-3H3