[3-methyl-4-[methyl(octyl)amino]-5-phenyl-thiophen-2-yl]boronic acid

Systemtic Name: [3-methyl-4-[methyl(octyl)amino]-5-phenyl-thiophen-2-yl]boronic acid Openeye Name: [3-methyl-4-[methyl(octyl)amino]-5-phenyl-2-thienyl]boronic acid CAS Name: [3-methyl-4-[methyl(octyl)amino]-5-phenyl-2-thiophenyl]boronic acid IUPAC Name: [3-methyl-4-[methyl(octyl)amino]-5-phenylthiophen-2-yl]boronic acid Traditional Name: [3-methyl-4-[methyl(octyl)amino]-5-phenyl-2-thienyl]boronic acid Formula: C20H30BNO2S MolecularWeight: 359.3337

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B(C1=C(C(=C(S1)C2=CC=CC=C2)N(C)CCCCCCCC)C)(O)O

Isomeric SMILES

B(C1=C(C(=C(S1)C2=CC=CC=C2)N(C)CCCCCCCC)C)(O)O

InChI

InChI=1S/C20H30BNO2S/c1-4-5-6-7-8-12-15-22(3)18-16(2)20(21(23)24)25-19(18)17-13-10-9-11-14-17/h9-11,13-14,23-24H,4-8,12,15H2,1-3H3