3,3-dibutyl-1,5-bis(oxidanylidene)-2,4,3-benzodioxastannepine-7-carboxylic acid

Systemtic Name: 3,3-dibutyl-1,5-bis(oxidanylidene)-2,4,3-benzodioxastannepine-7-carboxylic acid Openeye Name: 3,3-dibutyl-1,5-dioxo-2,4,3-benzodioxastannepine-7-carboxylic acid CAS Name: 3,3-dibutyl-1,5-dioxo-2,4,3-benzodioxastannepin-7-carboxylic acid IUPAC Name: 3,3-dibutyl-1,5-dioxo-2,4,3-benzodioxastannepine-7-carboxylic acid Traditional Name: 4,4-dibutyl-2,6-diketo-3,5-dioxa-4-stannabicyclo[5.4.0]undeca-1(7),8,10-triene-9-carboxylic acid Formula: C17H22O6Sn MolecularWeight: 441.06298

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn]1(OC(=O)C2=C(C=C(C=C2)C(=O)O)C(=O)O1)CCCC

Isomeric SMILES

CCCC[Sn]1(OC(=O)C2=C(C=C(C=C2)C(=O)O)C(=O)O1)CCCC

InChI

InChI=1S/C9H6O6.2C4H9.Sn/c10-7(11)4-1-2-5(8(12)13)6(3-4)9(14)15;2*1-3-4-2;/h1-3H,(H,10,11)(H,12,13)(H,14,15);2*1,3-4H2,2H3;/q;;;+2/p-2