N,N'-bis(2-methylquinolin-4-yl)decane-1,10-diamine; ethanoic acid

Systemtic Name: N,N'-bis(2-methylquinolin-4-yl)decane-1,10-diamine; ethanoic acid Openeye Name: acetic acid; N,N'-bis(2-methyl-4-quinolyl)decane-1,10-diamine CAS Name: acetic acid; N,N'-bis(2-methyl-4-quinolinyl)decane-1,10-diamine IUPAC Name: acetic acid; N,N'-bis(2-methylquinolin-4-yl)decane-1,10-diamine Traditional Name: acetic acid; (2-methyl-4-quinolyl)-[10-[(2-methyl-4-quinolyl)amino]decyl]amine Formula: C34H46N4O4 MolecularWeight: 574.75344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NCCCCCCCCCCNC3=CC(=NC4=CC=CC=C43)C.CC(=O)O.CC(=O)O

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NCCCCCCCCCCNC3=CC(=NC4=CC=CC=C43)C.CC(=O)O.CC(=O)O

InChI

InChI=1S/C30H38N4.2C2H4O2/c1-23-21-29(25-15-9-11-17-27(25)33-23)31-19-13-7-5-3-4-6-8-14-20-32-30-22-24(2)34-28-18-12-10-16-26(28)30;2*1-2(3)4/h9-12,15-18,21-22H,3-8,13-14,19-20H2,1-2H3,(H,31,33)(H,32,34);2*1H3,(H,3,4)