3-chloranyl-4-[(E)-2-ethyl-4-(2-oxidanyl-5-prop-1-en-2-yl-3,6-dihydro-1,2-oxaborinin-6-yl)but-1-enyl]phenol

Systemtic Name: 3-chloranyl-4-[(E)-2-ethyl-4-(2-oxidanyl-5-prop-1-en-2-yl-3,6-dihydro-1,2-oxaborinin-6-yl)but-1-enyl]phenol Openeye Name: 3-chloro-4-[(E)-2-ethyl-4-(2-hydroxy-5-isopropenyl-3,6-dihydrooxaborinin-6-yl)but-1-enyl]phenol CAS Name: 3-chloro-4-[(E)-2-ethyl-4-[2-hydroxy-5-(1-methylethenyl)-3,6-dihydrooxaborin-6-yl]but-1-enyl]phenol IUPAC Name: 3-chloro-4-[(E)-2-ethyl-4-(2-hydroxy-5-prop-1-en-2-yl-3,6-dihydrooxaborinin-6-yl)but-1-enyl]phenol Traditional Name: 3-chloro-4-[(E)-2-ethyl-4-(2-hydroxy-5-isopropenyl-3,6-dihydrooxaborin-6-yl)but-1-enyl]phenol Formula: C19H24BClO3 MolecularWeight: 346.65606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B1(CC=C(C(O1)CCC(=CC2=C(C=C(C=C2)O)Cl)CC)C(=C)C)O

Isomeric SMILES

B1(CC=C(C(O1)CC/C(=C/C2=C(C=C(C=C2)O)Cl)/CC)C(=C)C)O

InChI

InChI=1S/C19H24BClO3/c1-4-14(11-15-6-7-16(22)12-18(15)21)5-8-19-17(13(2)3)9-10-20(23)24-19/h6-7,9,11-12,19,22-23H,2,4-5,8,10H2,1,3H3/b14-11+