N',N'-diethyl-N-(6-methylquinolin-8-yl)hexane-1,6-diamine; ethanedioic acid

Systemtic Name: N',N'-diethyl-N-(6-methylquinolin-8-yl)hexane-1,6-diamine; ethanedioic acid Openeye Name: N',N'-diethyl-N-(6-methyl-8-quinolyl)hexane-1,6-diamine; oxalic acid CAS Name: N',N'-diethyl-N-(6-methyl-8-quinolinyl)hexane-1,6-diamine; oxalic acid IUPAC Name: N',N'-diethyl-N-(6-methylquinolin-8-yl)hexane-1,6-diamine; oxalic acid Traditional Name: diethyl-[6-[(6-methyl-8-quinolyl)amino]hexyl]amine; oxalic acid Formula: C22H33N3O4 MolecularWeight: 403.51512

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCCCCNC1=C2C(=CC(=C1)C)C=CC=N2.C(=O)(C(=O)O)O

Isomeric SMILES

CCN(CC)CCCCCCNC1=C2C(=CC(=C1)C)C=CC=N2.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H31N3.C2H2O4/c1-4-23(5-2)14-9-7-6-8-12-21-19-16-17(3)15-18-11-10-13-22-20(18)19;3-1(4)2(5)6/h10-11,13,15-16,21H,4-9,12,14H2,1-3H3;(H,3,4)(H,5,6)