N4-[6-[(6-azanyl-2-methyl-quinolin-4-yl)amino]hexyl]-2-methyl-quinoline-4,6-diamine; ethanoic acid

Systemtic Name: N4-[6-[(6-azanyl-2-methyl-quinolin-4-yl)amino]hexyl]-2-methyl-quinoline-4,6-diamine; ethanoic acid Openeye Name: acetic acid; N4-[6-[(6-amino-2-methyl-4-quinolyl)amino]hexyl]-2-methyl-quinoline-4,6-diamine CAS Name: acetic acid; N4-[6-[(6-amino-2-methyl-4-quinolinyl)amino]hexyl]-2-methylquinoline-4,6-diamine IUPAC Name: acetic acid; 4-N-[6-[(6-amino-2-methylquinolin-4-yl)amino]hexyl]-2-methylquinoline-4,6-diamine Traditional Name: acetic acid; (6-amino-2-methyl-4-quinolyl)-[6-[(6-amino-2-methyl-4-quinolyl)amino]hexyl]amine Formula: C28H36N6O2 MolecularWeight: 488.62444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)N)C(=C1)NCCCCCCNC3=CC(=NC4=C3C=C(C=C4)N)C.CC(=O)O

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)N)C(=C1)NCCCCCCNC3=CC(=NC4=C3C=C(C=C4)N)C.CC(=O)O

InChI

InChI=1S/C26H32N6.C2H4O2/c1-17-13-25(21-15-19(27)7-9-23(21)31-17)29-11-5-3-4-6-12-30-26-14-18(2)32-24-10-8-20(28)16-22(24)26;1-2(3)4/h7-10,13-16H,3-6,11-12,27-28H2,1-2H3,(H,29,31)(H,30,32);1H3,(H,3,4)