2-(3-methanoyl-8-methyl-quinolin-2-yl)sulfanylethanoate

Systemtic Name: 2-(3-methanoyl-8-methyl-quinolin-2-yl)sulfanylethanoate Openeye Name: 2-[(3-formyl-8-methyl-2-quinolyl)sulfanyl]acetate CAS Name: 2-[(3-formyl-8-methyl-2-quinolinyl)thio]acetate IUPAC Name: 2-(3-formyl-8-methylquinolin-2-yl)sulfanylacetate Traditional Name: 2-[(3-formyl-8-methyl-2-quinolyl)thio]acetate Formula: C13H10NO3S- MolecularWeight: 260.2884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=CC(=C(N=C12)SCC(=O)[O-])C=O

Isomeric SMILES

CC1=CC=CC2=CC(=C(N=C12)SCC(=O)[O-])C=O

InChI

InChI=1S/C13H11NO3S/c1-8-3-2-4-9-5-10(6-15)13(14-12(8)9)18-7-11(16)17/h2-6H,7H2,1H3,(H,16,17)/p-1