(4-cyanocyclohexyl) 4-(5-heptyl-1,3,2-dioxaborinan-2-yl)cyclohexane-1-carboxylate

Systemtic Name: (4-cyanocyclohexyl) 4-(5-heptyl-1,3,2-dioxaborinan-2-yl)cyclohexane-1-carboxylate Openeye Name: (4-cyanocyclohexyl) 4-(5-heptyl-1,3,2-dioxaborinan-2-yl)cyclohexanecarboxylate CAS Name: 4-(5-heptyl-1,3,2-dioxaborinan-2-yl)-1-cyclohexanecarboxylic acid (4-cyanocyclohexyl) ester IUPAC Name: (4-cyanocyclohexyl) 4-(5-heptyl-1,3,2-dioxaborinan-2-yl)cyclohexane-1-carboxylate Traditional Name: 4-(5-heptyl-1,3,2-dioxaborinan-2-yl)cyclohexanecarboxylic acid (4-cyanocyclohexyl) ester Formula: C24H40BNO4 MolecularWeight: 417.3897

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Descriptors Computed from Structure

Canonical SMILES:

B1(OCC(CO1)CCCCCCC)C2CCC(CC2)C(=O)OC3CCC(CC3)C#N

Isomeric SMILES

B1(OCC(CO1)CCCCCCC)C2CCC(CC2)C(=O)OC3CCC(CC3)C#N

InChI

InChI=1S/C24H40BNO4/c1-2-3-4-5-6-7-20-17-28-25(29-18-20)22-12-10-21(11-13-22)24(27)30-23-14-8-19(16-26)9-15-23/h19-23H,2-15,17-18H2,1H3