cyclopentane; (2-cyclopentylquinolin-5-yl)-phenyl-methanone; iron(2+); tributylstannanylium

Systemtic Name: cyclopentane; (2-cyclopentylquinolin-5-yl)-phenyl-methanone; iron(2+); tributylstannanylium Openeye Name: ferrous; cyclopentane; (2-cyclopentyl-5-quinolyl)-phenyl-methanone; tributylstannanylium CAS Name: cyclopentane; (2-cyclopentyl-5-quinolinyl)-phenylmethanone; iron(2+); tributylstannanylium IUPAC Name: cyclopentane; (2-cyclopentylquinolin-5-yl)-phenylmethanone; iron(2+); tributylstannanylium Traditional Name: ferrous; cyclopentane; (2-cyclopentyl-5-quinolyl)-phenyl-methanone; tributylstannanylium Formula: C38H45FeNOSn+2 MolecularWeight: 706.325

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn+](CCCC)CCCC.C1=CC=C(C=C1)C(=O)C2=C3C=CC(=NC3=CC=C2)[C]4[CH][CH][CH][CH]4.[CH]1[CH][CH][C-][CH]1.[Fe+2]

Isomeric SMILES

CCCC[Sn+](CCCC)CCCC.C1=CC=C(C=C1)C(=O)C2=C3C=CC(=NC3=CC=C2)[C]4[CH][CH][CH][CH]4.[CH]1[CH][CH][C-][CH]1.[Fe+2]

InChI

InChI=1S/C21H14NO.C5H4.3C4H9.Fe.Sn/c23-21(16-9-2-1-3-10-16)18-11-6-12-20-17(18)13-14-19(22-20)15-7-4-5-8-15;1-2-4-5-3-1;3*1-3-4-2;;/h1-14H;1-4H;3*1,3-4H2,2H3;;/q;-1;;;;+2;+1