N4-(7-chloranylquinolin-4-yl)-N1,N1-diethyl-pentane-1,4-diamine; titanium(4+); tetrachloride

Systemtic Name: N4-(7-chloranylquinolin-4-yl)-N1,N1-diethyl-pentane-1,4-diamine; titanium(4+); tetrachloride Openeye Name: N4-(7-chloro-4-quinolyl)-N1,N1-diethyl-pentane-1,4-diamine; titanium(4+); tetrachloride CAS Name: N4-(7-chloro-4-quinolinyl)-N1,N1-diethylpentane-1,4-diamine; titanium(4+); tetrachloride IUPAC Name: 4-N-(7-chloroquinolin-4-yl)-1-N,1-N-diethylpentane-1,4-diamine; titanium(4+); tetrachloride Traditional Name: 4-[(7-chloro-4-quinolyl)amino]pentyl-diethyl-amine; titanium(4+); tetrachloride Formula: C18H26Cl5N3Ti MolecularWeight: 509.55114

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl.[Cl-].[Cl-].[Cl-].[Cl-].[Ti+4]

Isomeric SMILES

CCN(CC)CCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl.[Cl-].[Cl-].[Cl-].[Cl-].[Ti+4]

InChI

InChI=1S/C18H26ClN3.4ClH.Ti/c1-4-22(5-2)12-6-7-14(3)21-17-10-11-20-18-13-15(19)8-9-16(17)18;;;;;/h8-11,13-14H,4-7,12H2,1-3H3,(H,20,21);4*1H;/q;;;;;+4/p-4