ethanedioic acid; N-(2-ethyl-3-methyl-quinolin-4-yl)-2-(4-methylpiperazin-1-yl)ethanamide

Systemtic Name: ethanedioic acid; N-(2-ethyl-3-methyl-quinolin-4-yl)-2-(4-methylpiperazin-1-yl)ethanamide Openeye Name: N-(2-ethyl-3-methyl-4-quinolyl)-2-(4-methylpiperazin-1-yl)acetamide; oxalic acid CAS Name: N-(2-ethyl-3-methyl-4-quinolinyl)-2-(4-methyl-1-piperazinyl)acetamide; oxalic acid IUPAC Name: N-(2-ethyl-3-methylquinolin-4-yl)-2-(4-methylpiperazin-1-yl)acetamide; oxalic acid Traditional Name: N-(2-ethyl-3-methyl-4-quinolyl)-2-(4-methylpiperazino)acetamide; oxalic acid Formula: C21H28N4O5 MolecularWeight: 416.47082

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C)NC(=O)CN3CCN(CC3)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C)NC(=O)CN3CCN(CC3)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H26N4O.C2H2O4/c1-4-16-14(2)19(15-7-5-6-8-17(15)20-16)21-18(24)13-23-11-9-22(3)10-12-23;3-1(4)2(5)6/h5-8H,4,9-13H2,1-3H3,(H,20,21,24);(H,3,4)(H,5,6)