ethanedioic acid; 2-(4-ethylpiperazin-1-yl)-7-methoxy-4-methyl-quinoline

Systemtic Name: ethanedioic acid; 2-(4-ethylpiperazin-1-yl)-7-methoxy-4-methyl-quinoline Openeye Name: 2-(4-ethylpiperazin-1-yl)-7-methoxy-4-methyl-quinoline; oxalic acid CAS Name: 2-(4-ethyl-1-piperazinyl)-7-methoxy-4-methylquinoline; oxalic acid IUPAC Name: 2-(4-ethylpiperazin-1-yl)-7-methoxy-4-methylquinoline; oxalic acid Traditional Name: 2-(4-ethylpiperazino)-7-methoxy-4-methyl-quinoline; oxalic acid Formula: C21H27N3O9 MolecularWeight: 465.45378

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC3=C(C=CC(=C3)OC)C(=C2)C.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1CCN(CC1)C2=NC3=C(C=CC(=C3)OC)C(=C2)C.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H23N3O.2C2H2O4/c1-4-19-7-9-20(10-8-19)17-11-13(2)15-6-5-14(21-3)12-16(15)18-17;2*3-1(4)2(5)6/h5-6,11-12H,4,7-10H2,1-3H3;2*(H,3,4)(H,5,6)