methyl 3-[bis[(1R,3R,4S,5R)-4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl]boranyl]-2-methylidene-butanoate

Systemtic Name: methyl 3-[bis[(1R,3R,4S,5R)-4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl]boranyl]-2-methylidene-butanoate Openeye Name: methyl 3-bis[(1R,2S,3R,5R)-2,6,6-trimethylnorpinan-3-yl]boranyl-2-methylene-butanoate CAS Name: 3-[bis[(1R,3R,4S,5R)-4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl]boranyl]-2-methylenebutanoic acid methyl ester IUPAC Name: methyl 3-[bis[(1R,3R,4S,5R)-4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl]boranyl]-2-methylidenebutanoate Traditional Name: 2-[1-bis[(1R,2S,3R,5R)-2,6,6-trimethylnorpinan-3-yl]boranylethyl]acrylic acid methyl ester Formula: C26H43BO2 MolecularWeight: 398.42942

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Descriptors Computed from Structure

Canonical SMILES:

B(C1CC2CC(C1C)C2(C)C)(C3CC4CC(C3C)C4(C)C)C(C)C(=C)C(=O)OC

Isomeric SMILES

B([C@@H]1C[C@@H]2C[C@H]([C@H]1C)C2(C)C)([C@@H]3C[C@@H]4C[C@H]([C@H]3C)C4(C)C)C(C)C(=C)C(=O)OC

InChI

InChI=1S/C26H43BO2/c1-14(24(28)29-9)17(4)27(22-12-18-10-20(15(22)2)25(18,5)6)23-13-19-11-21(16(23)3)26(19,7)8/h15-23H,1,10-13H2,2-9H3/t15-,16-,17?,18+,19+,20-,21-,22-,23-/m1/s1