IUPAC: 2-methyl-4-[3-[3-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pentan-3-yl]phenol

SMILES: CCC(CC)(c1ccc(O)c(C)c1)c1ccc(B2OC(C)(C)C(C)(C)O2)c(C)c1

Canonical SMILES: B1(OC(C(O1)(C)C)(C)C)C2=C(C=C(C=C2)C(CC)(CC)C3=CC(=C(C=C3)O)C)C

분자식: C25H35BO3

분자량: 394.40

InChIKey: NDERUVFYUSUSPU-UHFFFAOYSA-N

InChI:

InChI=1S/C25H35BO3/c1-9-25(10-2,20-12-14-22(27)18(4)16-20)19-11-13-21(17(3)15-19)26-28-23(5,6)24(7,8)29-26/h11-16,27H,9-10H2,1-8H3

동의어

SCHEMBL1525839NDERUVFYUSUSPU-UHFFFAOYSA-N4-{1-ethyl-1-[3-methyl-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-propyl}-2-methyl-phenol