4-chloranyl-2-methyl-3-(3-oxidanylidenebutyl)quinoline-6-carboxylic acid

Systemtic Name: 4-chloranyl-2-methyl-3-(3-oxidanylidenebutyl)quinoline-6-carboxylic acid Openeye Name: 4-chloro-2-methyl-3-(3-oxobutyl)quinoline-6-carboxylic acid CAS Name: 4-chloro-2-methyl-3-(3-oxobutyl)-6-quinolinecarboxylic acid IUPAC Name: 4-chloro-2-methyl-3-(3-oxobutyl)quinoline-6-carboxylic acid Traditional Name: 4-chloro-3-(3-ketobutyl)-2-methyl-quinoline-6-carboxylic acid Formula: C15H14ClNO3 MolecularWeight: 291.72956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)C(=O)O)C(=C1CCC(=O)C)Cl

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)C(=O)O)C(=C1CCC(=O)C)Cl

InChI

InChI=1S/C15H14ClNO3/c1-8(18)3-5-11-9(2)17-13-6-4-10(15(19)20)7-12(13)14(11)16/h4,6-7H,3,5H2,1-2H3,(H,19,20)