2,6-dimethyl-4-[(E)-2-methyl-4-(2-oxidanyl-5-pent-1-en-2-yl-3,6-dihydro-1,2-oxaborinin-6-yl)but-1-enyl]phenol

Systemtic Name: 2,6-dimethyl-4-[(E)-2-methyl-4-(2-oxidanyl-5-pent-1-en-2-yl-3,6-dihydro-1,2-oxaborinin-6-yl)but-1-enyl]phenol Openeye Name: 4-[(E)-4-[2-hydroxy-5-(1-methylenebutyl)-3,6-dihydrooxaborinin-6-yl]-2-methyl-but-1-enyl]-2,6-dimethyl-phenol CAS Name: 4-[(E)-4-(2-hydroxy-5-pent-1-en-2-yl-3,6-dihydrooxaborin-6-yl)-2-methylbut-1-enyl]-2,6-dimethylphenol IUPAC Name: 4-[(E)-4-(2-hydroxy-5-pent-1-en-2-yl-3,6-dihydrooxaborinin-6-yl)-2-methylbut-1-enyl]-2,6-dimethylphenol Traditional Name: 4-[(E)-4-[2-hydroxy-5-(1-propylvinyl)-3,6-dihydrooxaborin-6-yl]-2-methyl-but-1-enyl]-2,6-dimethyl-phenol Formula: C22H31BO3 MolecularWeight: 354.29074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H31BO3/c1-6-7-16(3)20-10-11-23(25)26-21(20)9-8-15(2)12-19-13-17(4)22(24)18(5)14-19/h10,12-14,21,24-25H,3,6-9,11H2,1-2,4-5H3/b15-12+