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

Systemtic Name: 7-[2-acetyloxy-3-(3-carboxy-1-ethyl-4-oxidanylidene-quinolin-7-yl)oxy-propoxy]-1-ethyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[2-acetoxy-3-[(3-carboxy-1-ethyl-4-oxo-7-quinolyl)oxy]propoxy]-1-ethyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[2-acetyloxy-3-[(3-carboxy-1-ethyl-4-oxo-7-quinolinyl)oxy]propoxy]-1-ethyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[2-acetyloxy-3-(3-carboxy-1-ethyl-4-oxoquinolin-7-yl)oxypropoxy]-1-ethyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[2-acetoxy-3-[(3-carboxy-1-ethyl-4-keto-7-quinolyl)oxy]propoxy]-1-ethyl-4-keto-quinoline-3-carboxylic acid Formula: C29H28N2O10 MolecularWeight: 564.54002

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=C(C=C2)OCC(COC3=CC4=C(C=C3)C(=O)C(=CN4CC)C(=O)O)OC(=O)C)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=C(C=C2)OCC(COC3=CC4=C(C=C3)C(=O)C(=CN4CC)C(=O)O)OC(=O)C)C(=O)O

InChI

InChI=1S/C29H28N2O10/c1-4-30-12-22(28(35)36)26(33)20-8-6-17(10-24(20)30)39-14-19(41-16(3)32)15-40-18-7-9-21-25(11-18)31(5-2)13-23(27(21)34)29(37)38/h6-13,19H,4-5,14-15H2,1-3H3,(H,35,36)(H,37,38)