[5,6-bis(fluoranyl)-2,3-dimethyl-quinolin-4-yl] 2-oxidanylidenehept-6-ynoate

Systemtic Name: [5,6-bis(fluoranyl)-2,3-dimethyl-quinolin-4-yl] 2-oxidanylidenehept-6-ynoate Openeye Name: (5,6-difluoro-2,3-dimethyl-4-quinolyl) 2-oxohept-6-ynoate CAS Name: 2-oxo-6-heptynoic acid (5,6-difluoro-2,3-dimethyl-4-quinolinyl) ester IUPAC Name: (5,6-difluoro-2,3-dimethylquinolin-4-yl) 2-oxohept-6-ynoate Traditional Name: 2-ketohept-6-ynoic acid (5,6-difluoro-2,3-dimethyl-4-quinolyl) ester Formula: C18H15F2NO3 MolecularWeight: 331.313406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=CC(=C2F)F)N=C1C)OC(=O)C(=O)CCCC#C

Isomeric SMILES

CC1=C(C2=C(C=CC(=C2F)F)N=C1C)OC(=O)C(=O)CCCC#C

InChI

InChI=1S/C18H15F2NO3/c1-4-5-6-7-14(22)18(23)24-17-10(2)11(3)21-13-9-8-12(19)16(20)15(13)17/h1,8-9H,5-7H2,2-3H3