N-(3-ethyl-2-propyl-quinolin-4-yl)-2-(4-phenylpiperazine-1,4-diium-1-yl)ethanamide; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: N-(3-ethyl-2-propyl-quinolin-4-yl)-2-(4-phenylpiperazine-1,4-diium-1-yl)ethanamide; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: N-(3-ethyl-2-propyl-4-quinolyl)-2-(4-phenylpiperazine-1,4-diium-1-yl)acetamide; 2-hydroxy-2-oxo-acetate CAS Name: N-(3-ethyl-2-propyl-4-quinolinyl)-2-(4-phenyl-1-piperazine-1,4-diiumyl)acetamide; 2-hydroxy-2-oxoacetate IUPAC Name: N-(3-ethyl-2-propylquinolin-4-yl)-2-(4-phenylpiperazine-1,4-diium-1-yl)acetamide; 2-hydroxy-2-oxoacetate Traditional Name: N-(3-ethyl-2-propyl-4-quinolyl)-2-(4-phenylpiperazine-1,4-diium-1-yl)acetamide dibinoxalate Formula: C30H36N4O9 MolecularWeight: 596.62824

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=CC=CC=C2C(=C1CC)NC(=O)C[NH+]3CC[NH+](CC3)C4=CC=CC=C4.C(=O)(C(=O)[O-])O.C(=O)(C(=O)[O-])O

Isomeric SMILES

CCCC1=NC2=CC=CC=C2C(=C1CC)NC(=O)C[NH+]3CC[NH+](CC3)C4=CC=CC=C4.C(=O)(C(=O)[O-])O.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C26H32N4O.2C2H2O4/c1-3-10-23-21(4-2)26(22-13-8-9-14-24(22)27-23)28-25(31)19-29-15-17-30(18-16-29)20-11-6-5-7-12-20;2*3-1(4)2(5)6/h5-9,11-14H,3-4,10,15-19H2,1-2H3,(H,27,28,31);2*(H,3,4)(H,5,6)