N',N'-diethyl-N-isoquinolin-1-yl-butane-1,4-diamine chloride

Systemtic Name: N',N'-diethyl-N-isoquinolin-1-yl-butane-1,4-diamine chloride Openeye Name: N',N'-diethyl-N-(1-isoquinolyl)butane-1,4-diamine chloride CAS Name: N',N'-diethyl-N-(1-isoquinolinyl)butane-1,4-diamine chloride IUPAC Name: N',N'-diethyl-N-isoquinolin-1-ylbutane-1,4-diamine chloride Traditional Name: diethyl-[4-(1-isoquinolylamino)butyl]amine chloride Formula: C17H25ClN3- MolecularWeight: 306.8535

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCCNC1=NC=CC2=CC=CC=C21.[Cl-]

Isomeric SMILES

CCN(CC)CCCCNC1=NC=CC2=CC=CC=C21.[Cl-]

InChI

InChI=1S/C17H25N3.ClH/c1-3-20(4-2)14-8-7-12-18-17-16-10-6-5-9-15(16)11-13-19-17;/h5-6,9-11,13H,3-4,7-8,12,14H2,1-2H3,(H,18,19);1H/p-1