(E)-3-(1-methyl-6-methylsulfanyl-4-oxidanylidene-quinolin-3-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(1-methyl-6-methylsulfanyl-4-oxidanylidene-quinolin-3-yl)prop-2-enoic acid Openeye Name: (E)-3-(1-methyl-6-methylsulfanyl-4-oxo-3-quinolyl)prop-2-enoic acid CAS Name: (E)-3-[1-methyl-6-(methylthio)-4-oxo-3-quinolinyl]-2-propenoic acid IUPAC Name: (E)-3-(1-methyl-6-methylsulfanyl-4-oxoquinolin-3-yl)prop-2-enoic acid Traditional Name: (E)-3-[4-keto-1-methyl-6-(methylthio)-3-quinolyl]acrylic acid Formula: C14H13NO3S MolecularWeight: 275.32292

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)C2=C1C=CC(=C2)SC)C=CC(=O)O

Isomeric SMILES

CN1C=C(C(=O)C2=C1C=CC(=C2)SC)/C=C/C(=O)O

InChI

InChI=1S/C14H13NO3S/c1-15-8-9(3-6-13(16)17)14(18)11-7-10(19-2)4-5-12(11)15/h3-8H,1-2H3,(H,16,17)/b6-3+