6-[3-(3-carboxy-1-ethyl-4-oxidanylidene-quinolin-6-yl)oxy-2-oxidanyl-propoxy]-1-ethyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6-[3-(3-carboxy-1-ethyl-4-oxidanylidene-quinolin-6-yl)oxy-2-oxidanyl-propoxy]-1-ethyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-[3-[(3-carboxy-1-ethyl-4-oxo-6-quinolyl)oxy]-2-hydroxy-propoxy]-1-ethyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-[3-[(3-carboxy-1-ethyl-4-oxo-6-quinolinyl)oxy]-2-hydroxypropoxy]-1-ethyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-[3-(3-carboxy-1-ethyl-4-oxoquinolin-6-yl)oxy-2-hydroxypropoxy]-1-ethyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-[3-[(3-carboxy-1-ethyl-4-keto-6-quinolyl)oxy]-2-hydroxy-propoxy]-1-ethyl-4-keto-quinoline-3-carboxylic acid Formula: C27H26N2O9 MolecularWeight: 522.50334

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=CC(=C2)OCC(COC3=CC4=C(C=C3)N(C=C(C4=O)C(=O)O)CC)O)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=CC(=C2)OCC(COC3=CC4=C(C=C3)N(C=C(C4=O)C(=O)O)CC)O)C(=O)O

InChI

InChI=1S/C27H26N2O9/c1-3-28-11-20(26(33)34)24(31)18-9-16(5-7-22(18)28)37-13-15(30)14-38-17-6-8-23-19(10-17)25(32)21(27(35)36)12-29(23)4-2/h5-12,15,30H,3-4,13-14H2,1-2H3,(H,33,34)(H,35,36)