N4-(4-chloranylisoquinolin-1-yl)-N1,N1-diethyl-pentane-1,4-diamine

Systemtic Name: N4-(4-chloranylisoquinolin-1-yl)-N1,N1-diethyl-pentane-1,4-diamine Openeye Name: N4-(4-chloro-1-isoquinolyl)-N1,N1-diethyl-pentane-1,4-diamine CAS Name: N4-(4-chloro-1-isoquinolinyl)-N1,N1-diethylpentane-1,4-diamine IUPAC Name: 4-N-(4-chloroisoquinolin-1-yl)-1-N,1-N-diethylpentane-1,4-diamine Traditional Name: 4-[(4-chloro-1-isoquinolyl)amino]pentyl-diethyl-amine Formula: C18H26ClN3 MolecularWeight: 319.87214

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(C)NC1=NC=C(C2=CC=CC=C21)Cl

Isomeric SMILES

CCN(CC)CCCC(C)NC1=NC=C(C2=CC=CC=C21)Cl

InChI

InChI=1S/C18H26ClN3/c1-4-22(5-2)12-8-9-14(3)21-18-16-11-7-6-10-15(16)17(19)13-20-18/h6-7,10-11,13-14H,4-5,8-9,12H2,1-3H3,(H,20,21)