8-[1-(3-methylbutyl)benzimidazol-2-yl]quinoline; platinum(4+); propanoate; dichloride

Systemtic Name: 8-[1-(3-methylbutyl)benzimidazol-2-yl]quinoline; platinum(4+); propanoate; dichloride Openeye Name: 8-(1-isopentylbenzimidazol-2-yl)quinoline; platinum(4+); propanoate; dichloride CAS Name: 8-[1-(3-methylbutyl)-2-benzimidazolyl]quinoline; platinum(4+); propanoate; dichloride IUPAC Name: 8-[1-(3-methylbutyl)benzimidazol-2-yl]quinoline; platinum(4+); propanoate; dichloride Traditional Name: 8-(1-isoamylbenzimidazol-2-yl)quinoline; platinum(4+); propionate; dichloride Formula: C27H31Cl2N3O4Pt MolecularWeight: 727.53674

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)[O-].CCC(=O)[O-].CC(C)CCN1C2=CC=CC=C2N=C1C3=CC=CC4=C3N=CC=C4.[Cl-].[Cl-].[Pt+4]

Isomeric SMILES

CCC(=O)[O-].CCC(=O)[O-].CC(C)CCN1C2=CC=CC=C2N=C1C3=CC=CC4=C3N=CC=C4.[Cl-].[Cl-].[Pt+4]

InChI

InChI=1S/C21H21N3.2C3H6O2.2ClH.Pt/c1-15(2)12-14-24-19-11-4-3-10-18(19)23-21(24)17-9-5-7-16-8-6-13-22-20(16)17;2*1-2-3(4)5;;;/h3-11,13,15H,12,14H2,1-2H3;2*2H2,1H3,(H,4,5);2*1H;/q;;;;;+4/p-4