N4-[[2-(3-butylisoquinolin-1-yl)oxyethyl-methyl-amino]methyl]pentane-1,4-diamine

Systemtic Name: N4-[[2-(3-butylisoquinolin-1-yl)oxyethyl-methyl-amino]methyl]pentane-1,4-diamine Openeye Name: N4-[[2-[(3-butyl-1-isoquinolyl)oxy]ethyl-methyl-amino]methyl]pentane-1,4-diamine CAS Name: N4-[[2-[(3-butyl-1-isoquinolinyl)oxy]ethyl-methylamino]methyl]pentane-1,4-diamine IUPAC Name: 4-N-[[2-(3-butylisoquinolin-1-yl)oxyethyl-methylamino]methyl]pentane-1,4-diamine Traditional Name: [(4-amino-1-methyl-butyl)amino]methyl-[2-[(3-butyl-1-isoquinolyl)oxy]ethyl]-methyl-amine Formula: C22H36N4O MolecularWeight: 372.54744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=CC=CC=C2C(=N1)OCCN(C)CNC(C)CCCN

Isomeric SMILES

CCCCC1=CC2=CC=CC=C2C(=N1)OCCN(C)CNC(C)CCCN

InChI

InChI=1S/C22H36N4O/c1-4-5-11-20-16-19-10-6-7-12-21(19)22(25-20)27-15-14-26(3)17-24-18(2)9-8-13-23/h6-7,10,12,16,18,24H,4-5,8-9,11,13-15,17,23H2,1-3H3