8-chloranyl-2-methyl-3-(3-oxidanylidenebutyl)quinoline-4-thiolate

Systemtic Name: 8-chloranyl-2-methyl-3-(3-oxidanylidenebutyl)quinoline-4-thiolate Openeye Name: 8-chloro-2-methyl-3-(3-oxobutyl)quinoline-4-thiolate CAS Name: 8-chloro-2-methyl-3-(3-oxobutyl)-4-quinolinethiolate IUPAC Name: 8-chloro-2-methyl-3-(3-oxobutyl)quinoline-4-thiolate Traditional Name: 8-chloro-3-(3-ketobutyl)-2-methyl-quinoline-4-thiolate Formula: C14H13ClNOS- MolecularWeight: 278.77712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2Cl)C(=C1CCC(=O)C)[S-]

Isomeric SMILES

CC1=NC2=C(C=CC=C2Cl)C(=C1CCC(=O)C)[S-]

InChI

InChI=1S/C14H14ClNOS/c1-8(17)6-7-10-9(2)16-13-11(14(10)18)4-3-5-12(13)15/h3-5H,6-7H2,1-2H3,(H,16,18)/p-1