N-(7-chloranylisoquinolin-1-yl)-N',N'-diethyl-propane-1,3-diamine hydrochloride

Systemtic Name: N-(7-chloranylisoquinolin-1-yl)-N',N'-diethyl-propane-1,3-diamine hydrochloride Openeye Name: N-(7-chloro-1-isoquinolyl)-N',N'-diethyl-propane-1,3-diamine hydrochloride CAS Name: N-(7-chloro-1-isoquinolinyl)-N',N'-diethylpropane-1,3-diamine hydrochloride IUPAC Name: N-(7-chloroisoquinolin-1-yl)-N',N'-diethylpropane-1,3-diamine hydrochloride Traditional Name: 3-[(7-chloro-1-isoquinolyl)amino]propyl-diethyl-amine hydrochloride Formula: C16H23Cl2N3 MolecularWeight: 328.27992

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC1=NC=CC2=C1C=C(C=C2)Cl.Cl

Isomeric SMILES

CCN(CC)CCCNC1=NC=CC2=C1C=C(C=C2)Cl.Cl

InChI

InChI=1S/C16H22ClN3.ClH/c1-3-20(4-2)11-5-9-18-16-15-12-14(17)7-6-13(15)8-10-19-16;/h6-8,10,12H,3-5,9,11H2,1-2H3,(H,18,19);1H