[4-(3-oxidanyl-5-pyridin-3-yl-pentan-2-yl)oxyphenyl]boronic acid

Systemtic Name: [4-(3-oxidanyl-5-pyridin-3-yl-pentan-2-yl)oxyphenyl]boronic acid Openeye Name: [4-[2-hydroxy-1-methyl-4-(3-pyridyl)butoxy]phenyl]boronic acid CAS Name: [4-[3-hydroxy-5-(3-pyridinyl)pentan-2-yl]oxyphenyl]boronic acid IUPAC Name: [4-(3-hydroxy-5-pyridin-3-ylpentan-2-yl)oxyphenyl]boronic acid Traditional Name: [4-[2-hydroxy-1-methyl-4-(3-pyridyl)butoxy]phenyl]boronic acid Formula: C16H20BNO4 MolecularWeight: 301.1453

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=C(C=C1)OC(C)C(CCC2=CN=CC=C2)O)(O)O

Isomeric SMILES

B(C1=CC=C(C=C1)OC(C)C(CCC2=CN=CC=C2)O)(O)O

InChI

InChI=1S/C16H20BNO4/c1-12(16(19)9-4-13-3-2-10-18-11-13)22-15-7-5-14(6-8-15)17(20)21/h2-3,5-8,10-12,16,19-21H,4,9H2,1H3