2-ethoxycarbonyl-6-ethylsulfanyl-4-oxidanylidene-10-propyl-pyrano[3,2-g]quinoline-8-carboxylic acid

Systemtic Name: 2-ethoxycarbonyl-6-ethylsulfanyl-4-oxidanylidene-10-propyl-pyrano[3,2-g]quinoline-8-carboxylic acid Openeye Name: 2-ethoxycarbonyl-6-ethylsulfanyl-4-oxo-10-propyl-pyrano[3,2-g]quinoline-8-carboxylic acid CAS Name: 2-ethoxycarbonyl-6-(ethylthio)-4-oxo-10-propyl-8-pyrano[3,2-g]quinolinecarboxylic acid IUPAC Name: 2-ethoxycarbonyl-6-ethylsulfanyl-4-oxo-10-propylpyrano[3,2-g]quinoline-8-carboxylic acid Traditional Name: 2-carbethoxy-6-(ethylthio)-4-keto-10-propyl-pyrano[3,2-g]quinoline-8-carboxylic acid Formula: C21H21NO6S MolecularWeight: 415.45954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=CC3=C1OC(=CC3=O)C(=O)OCC)C(=CC(=N2)C(=O)O)SCC

Isomeric SMILES

CCCC1=C2C(=CC3=C1OC(=CC3=O)C(=O)OCC)C(=CC(=N2)C(=O)O)SCC

InChI

InChI=1S/C21H21NO6S/c1-4-7-11-18-13(17(29-6-3)9-14(22-18)20(24)25)8-12-15(23)10-16(28-19(11)12)21(26)27-5-2/h8-10H,4-7H2,1-3H3,(H,24,25)