ethyl 4-hex-1-ynyl-2-methyl-quinoline-3-carboxylate

Systemtic Name: ethyl 4-hex-1-ynyl-2-methyl-quinoline-3-carboxylate Openeye Name: ethyl 4-hex-1-ynyl-2-methyl-quinoline-3-carboxylate CAS Name: 4-hex-1-ynyl-2-methyl-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-hex-1-ynyl-2-methylquinoline-3-carboxylate Traditional Name: 4-hex-1-ynyl-2-methyl-quinoline-3-carboxylic acid ethyl ester Formula: C19H21NO2 MolecularWeight: 295.37554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=C(C(=NC2=CC=CC=C21)C)C(=O)OCC

Isomeric SMILES

CCCCC#CC1=C(C(=NC2=CC=CC=C21)C)C(=O)OCC

InChI

InChI=1S/C19H21NO2/c1-4-6-7-8-12-16-15-11-9-10-13-17(15)20-14(3)18(16)19(21)22-5-2/h9-11,13H,4-7H2,1-3H3