4-bromanyl-2-[(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: 4-bromanyl-2-[(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-bromo-2-[(E)-4-[2-hydroxy-5-(1-methylenebutyl)-3,6-dihydrooxaborinin-6-yl]-2-methyl-but-1-enyl]phenol CAS Name: 4-bromo-2-[(E)-4-(2-hydroxy-5-pent-1-en-2-yl-3,6-dihydrooxaborin-6-yl)-2-methylbut-1-enyl]phenol IUPAC Name: 4-bromo-2-[(E)-4-(2-hydroxy-5-pent-1-en-2-yl-3,6-dihydrooxaborinin-6-yl)-2-methylbut-1-enyl]phenol Traditional Name: 4-bromo-2-[(E)-4-[2-hydroxy-5-(1-propylvinyl)-3,6-dihydrooxaborin-6-yl]-2-methyl-but-1-enyl]phenol Formula: C20H26BBrO3 MolecularWeight: 405.13364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26BBrO3/c1-4-5-15(3)18-10-11-21(24)25-20(18)9-6-14(2)12-16-13-17(22)7-8-19(16)23/h7-8,10,12-13,20,23-24H,3-6,9,11H2,1-2H3/b14-12+