3-methylbutanoyl quinoline-2-carboxylate

Systemtic Name: 3-methylbutanoyl quinoline-2-carboxylate Openeye Name: 3-methylbutanoyl quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid (3-methyl-1-oxobutyl) ester IUPAC Name: 3-methylbutanoyl quinoline-2-carboxylate Traditional Name: quinaldic acid isovaleryl ester Formula: C15H15NO3 MolecularWeight: 257.2845

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)OC(=O)C1=NC2=CC=CC=C2C=C1

Isomeric SMILES

CC(C)CC(=O)OC(=O)C1=NC2=CC=CC=C2C=C1

InChI

InChI=1S/C15H15NO3/c1-10(2)9-14(17)19-15(18)13-8-7-11-5-3-4-6-12(11)16-13/h3-8,10H,9H2,1-2H3