3-[(Z)-4-[(6R)-2-oxidanyl-3,6-dihydro-1,2-oxaborinin-6-yl]-2-pyridin-2-yl-but-1-enyl]phenol

Systemtic Name: 3-[(Z)-4-[(6R)-2-oxidanyl-3,6-dihydro-1,2-oxaborinin-6-yl]-2-pyridin-2-yl-but-1-enyl]phenol Openeye Name: 3-[(Z)-4-[(6R)-2-hydroxy-3,6-dihydrooxaborinin-6-yl]-2-(2-pyridyl)but-1-enyl]phenol CAS Name: 3-[(Z)-4-[(6R)-2-hydroxy-3,6-dihydrooxaborin-6-yl]-2-(2-pyridinyl)but-1-enyl]phenol IUPAC Name: 3-[(Z)-4-[(6R)-2-hydroxy-3,6-dihydrooxaborinin-6-yl]-2-pyridin-2-ylbut-1-enyl]phenol Traditional Name: 3-[(Z)-4-[(6R)-2-hydroxy-3,6-dihydrooxaborin-6-yl]-2-(2-pyridyl)but-1-enyl]phenol Formula: C19H20BNO3 MolecularWeight: 321.178

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Descriptors Computed from Structure

Canonical SMILES:

B1(CC=CC(O1)CCC(=CC2=CC(=CC=C2)O)C3=CC=CC=N3)O

Isomeric SMILES

B1(CC=C[C@H](O1)CC/C(=C/C2=CC(=CC=C2)O)/C3=CC=CC=N3)O

InChI

InChI=1S/C19H20BNO3/c22-17-6-3-5-15(14-17)13-16(19-8-1-2-12-21-19)9-10-18-7-4-11-20(23)24-18/h1-8,12-14,18,22-23H,9-11H2/b16-13-/t18-/m0/s1