N-(3-ethyl-2-propyl-quinolin-4-yl)-2-[4-(2-methoxyphenyl)piperazine-1,4-diium-1-yl]ethanamide; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: N-(3-ethyl-2-propyl-quinolin-4-yl)-2-[4-(2-methoxyphenyl)piperazine-1,4-diium-1-yl]ethanamide; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: N-(3-ethyl-2-propyl-4-quinolyl)-2-[4-(2-methoxyphenyl)piperazine-1,4-diium-1-yl]acetamide; 2-hydroxy-2-oxo-acetate CAS Name: N-(3-ethyl-2-propyl-4-quinolinyl)-2-[4-(2-methoxyphenyl)-1-piperazine-1,4-diiumyl]acetamide; 2-hydroxy-2-oxoacetate IUPAC Name: N-(3-ethyl-2-propylquinolin-4-yl)-2-[4-(2-methoxyphenyl)piperazine-1,4-diium-1-yl]acetamide; 2-hydroxy-2-oxoacetate Traditional Name: N-(3-ethyl-2-propyl-4-quinolyl)-2-[4-(2-methoxyphenyl)piperazine-1,4-diium-1-yl]acetamide dibinoxalate Formula: C31H38N4O10 MolecularWeight: 626.65422

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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=C4OC.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=C4OC.C(=O)(C(=O)[O-])O.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C27H34N4O2.2C2H2O4/c1-4-10-22-20(5-2)27(21-11-6-7-12-23(21)28-22)29-26(32)19-30-15-17-31(18-16-30)24-13-8-9-14-25(24)33-3;2*3-1(4)2(5)6/h6-9,11-14H,4-5,10,15-19H2,1-3H3,(H,28,29,32);2*(H,3,4)(H,5,6)