methyl 7-oxidanylidene-8-quinolin-2-yl-oct-2-ynoate

Systemtic Name: methyl 7-oxidanylidene-8-quinolin-2-yl-oct-2-ynoate Openeye Name: methyl 7-oxo-8-(2-quinolyl)oct-2-ynoate CAS Name: 7-oxo-8-(2-quinolinyl)-2-octynoic acid methyl ester IUPAC Name: methyl 7-oxo-8-quinolin-2-yloct-2-ynoate Traditional Name: 7-keto-8-(2-quinolyl)oct-2-ynoic acid methyl ester Formula: C18H17NO3 MolecularWeight: 295.33248

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C#CCCCC(=O)CC1=NC2=CC=CC=C2C=C1

Isomeric SMILES

COC(=O)C#CCCCC(=O)CC1=NC2=CC=CC=C2C=C1

InChI

InChI=1S/C18H17NO3/c1-22-18(21)10-4-2-3-8-16(20)13-15-12-11-14-7-5-6-9-17(14)19-15/h5-7,9,11-12H,2-3,8,13H2,1H3