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

Systemtic Name: 3-[(E)-4-(5-but-1-en-2-yl-2-oxidanyl-3,6-dihydro-1,2-oxaborinin-6-yl)-2-ethyl-but-1-enyl]phenol Openeye Name: 3-[(E)-2-ethyl-4-[2-hydroxy-5-(1-methylenepropyl)-3,6-dihydrooxaborinin-6-yl]but-1-enyl]phenol CAS Name: 3-[(E)-4-(5-but-1-en-2-yl-2-hydroxy-3,6-dihydrooxaborin-6-yl)-2-ethylbut-1-enyl]phenol IUPAC Name: 3-[(E)-4-(5-but-1-en-2-yl-2-hydroxy-3,6-dihydrooxaborinin-6-yl)-2-ethylbut-1-enyl]phenol Traditional Name: 3-[(E)-2-ethyl-4-[5-(1-ethylvinyl)-2-hydroxy-3,6-dihydrooxaborin-6-yl]but-1-enyl]phenol Formula: C20H27BO3 MolecularWeight: 326.23758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27BO3/c1-4-15(3)19-11-12-21(23)24-20(19)10-9-16(5-2)13-17-7-6-8-18(22)14-17/h6-8,11,13-14,20,22-23H,3-5,9-10,12H2,1-2H3/b16-13+