6-(4-carboxy-3-ethyl-2-propyl-quinolin-6-yl)oxy-3-ethyl-2-propyl-quinoline-4-carboxylic acid

Systemtic Name: 6-(4-carboxy-3-ethyl-2-propyl-quinolin-6-yl)oxy-3-ethyl-2-propyl-quinoline-4-carboxylic acid Openeye Name: 6-[(4-carboxy-3-ethyl-2-propyl-6-quinolyl)oxy]-3-ethyl-2-propyl-quinoline-4-carboxylic acid CAS Name: 6-[(4-carboxy-3-ethyl-2-propyl-6-quinolinyl)oxy]-3-ethyl-2-propyl-4-quinolinecarboxylic acid IUPAC Name: 6-(4-carboxy-3-ethyl-2-propylquinolin-6-yl)oxy-3-ethyl-2-propylquinoline-4-carboxylic acid Traditional Name: 6-[(4-carboxy-3-ethyl-2-propyl-6-quinolyl)oxy]-3-ethyl-2-propyl-cinchoninic acid Formula: C30H32N2O5 MolecularWeight: 500.58548

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C2C=C(C=CC2=N1)OC3=CC4=C(C(=C(N=C4C=C3)CCC)CC)C(=O)O)C(=O)O)CC

Isomeric SMILES

CCCC1=C(C(=C2C=C(C=CC2=N1)OC3=CC4=C(C(=C(N=C4C=C3)CCC)CC)C(=O)O)C(=O)O)CC

InChI

InChI=1S/C30H32N2O5/c1-5-9-23-19(7-3)27(29(33)34)21-15-17(11-13-25(21)31-23)37-18-12-14-26-22(16-18)28(30(35)36)20(8-4)24(32-26)10-6-2/h11-16H,5-10H2,1-4H3,(H,33,34)(H,35,36)