7-[3-(3-carboxy-1-methyl-4-oxidanylidene-quinolin-7-yl)oxy-2-oxidanyl-propoxy]-1-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[3-(3-carboxy-1-methyl-4-oxidanylidene-quinolin-7-yl)oxy-2-oxidanyl-propoxy]-1-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[3-[(3-carboxy-1-methyl-4-oxo-7-quinolyl)oxy]-2-hydroxy-propoxy]-1-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[3-[(3-carboxy-1-methyl-4-oxo-7-quinolinyl)oxy]-2-hydroxypropoxy]-1-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[3-(3-carboxy-1-methyl-4-oxoquinolin-7-yl)oxy-2-hydroxypropoxy]-1-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[3-[(3-carboxy-4-keto-1-methyl-7-quinolyl)oxy]-2-hydroxy-propoxy]-4-keto-1-methyl-quinoline-3-carboxylic acid Formula: C25H22N2O9 MolecularWeight: 494.45018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)C2=C1C=C(C=C2)OCC(COC3=CC4=C(C=C3)C(=O)C(=CN4C)C(=O)O)O)C(=O)O

Isomeric SMILES

CN1C=C(C(=O)C2=C1C=C(C=C2)OCC(COC3=CC4=C(C=C3)C(=O)C(=CN4C)C(=O)O)O)C(=O)O

InChI

InChI=1S/C25H22N2O9/c1-26-9-18(24(31)32)22(29)16-5-3-14(7-20(16)26)35-11-13(28)12-36-15-4-6-17-21(8-15)27(2)10-19(23(17)30)25(33)34/h3-10,13,28H,11-12H2,1-2H3,(H,31,32)(H,33,34)