4-oxidanylidene-6-phenoxysulfinyl-10-propyl-pyrano[3,2-g]quinoline-2,8-dicarboxylic acid

Systemtic Name: 4-oxidanylidene-6-phenoxysulfinyl-10-propyl-pyrano[3,2-g]quinoline-2,8-dicarboxylic acid Openeye Name: 4-oxo-6-phenoxysulfinyl-10-propyl-pyrano[3,2-g]quinoline-2,8-dicarboxylic acid CAS Name: 4-oxo-6-phenoxysulfinyl-10-propylpyrano[3,2-g]quinoline-2,8-dicarboxylic acid IUPAC Name: 4-oxo-6-phenoxysulfinyl-10-propylpyrano[3,2-g]quinoline-2,8-dicarboxylic acid Traditional Name: 4-keto-6-phenoxysulfinyl-10-propyl-pyrano[3,2-g]quinoline-2,8-dicarboxylic acid Formula: C23H17NO8S MolecularWeight: 467.44798

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=CC3=C1OC(=CC3=O)C(=O)O)C(=CC(=N2)C(=O)O)S(=O)OC4=CC=CC=C4

Isomeric SMILES

CCCC1=C2C(=CC3=C1OC(=CC3=O)C(=O)O)C(=CC(=N2)C(=O)O)S(=O)OC4=CC=CC=C4

InChI

InChI=1S/C23H17NO8S/c1-2-6-13-20-15(9-14-17(25)11-18(23(28)29)31-21(13)14)19(10-16(24-20)22(26)27)33(30)32-12-7-4-3-5-8-12/h3-5,7-11H,2,6H2,1H3,(H,26,27)(H,28,29)