6-chloranyl-3-cyclopentyl-8-nitro-quinoline; cyclopentane; iron(2+); tributylstannanylium

Systemtic Name: 6-chloranyl-3-cyclopentyl-8-nitro-quinoline; cyclopentane; iron(2+); tributylstannanylium Openeye Name: ferrous; 6-chloro-3-cyclopentyl-8-nitro-quinoline; cyclopentane; tributylstannanylium CAS Name: 6-chloro-3-cyclopentyl-8-nitroquinoline; cyclopentane; iron(2+); tributylstannanylium IUPAC Name: 6-chloro-3-cyclopentyl-8-nitroquinoline; cyclopentane; iron(2+); tributylstannanylium Traditional Name: ferrous; 6-chloro-3-cyclopentyl-8-nitro-quinoline; cyclopentane; tributylstannanylium Formula: C31H39ClFeN2O2Sn+2 MolecularWeight: 681.66156

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn+](CCCC)CCCC.[CH]1[CH][CH][C-][CH]1.[CH]1[CH][CH][C]([CH]1)C2=CN=C3C(=C2)C=C(C=C3[N+](=O)[O-])Cl.[Fe+2]

Isomeric SMILES

CCCC[Sn+](CCCC)CCCC.[CH]1[CH][CH][C-][CH]1.[CH]1[CH][CH][C]([CH]1)C2=CN=C3C(=C2)C=C(C=C3[N+](=O)[O-])Cl.[Fe+2]

InChI

InChI=1S/C14H8ClN2O2.C5H4.3C4H9.Fe.Sn/c15-12-6-10-5-11(9-3-1-2-4-9)8-16-14(10)13(7-12)17(18)19;1-2-4-5-3-1;3*1-3-4-2;;/h1-8H;1-4H;3*1,3-4H2,2H3;;/q;-1;;;;+2;+1