ethanedioic acid; 2-(4-methylpiperazin-1-yl)-4-phenyl-quinoline

Systemtic Name: ethanedioic acid; 2-(4-methylpiperazin-1-yl)-4-phenyl-quinoline Openeye Name: 2-(4-methylpiperazin-1-yl)-4-phenyl-quinoline; oxalic acid CAS Name: 2-(4-methyl-1-piperazinyl)-4-phenylquinoline; oxalic acid IUPAC Name: 2-(4-methylpiperazin-1-yl)-4-phenylquinoline; oxalic acid Traditional Name: 2-(4-methylpiperazino)-4-phenyl-quinoline; oxalic acid Formula: C24H25N3O8 MolecularWeight: 483.4706

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC3=CC=CC=C3C(=C2)C4=CC=CC=C4.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

CN1CCN(CC1)C2=NC3=CC=CC=C3C(=C2)C4=CC=CC=C4.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H21N3.2C2H2O4/c1-22-11-13-23(14-12-22)20-15-18(16-7-3-2-4-8-16)17-9-5-6-10-19(17)21-20;2*3-1(4)2(5)6/h2-10,15H,11-14H2,1H3;2*(H,3,4)(H,5,6)