4-[(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: 4-[(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: 4-[(E)-2-ethyl-4-[2-hydroxy-5-(1-methylenepropyl)-3,6-dihydrooxaborinin-6-yl]but-1-enyl]phenol CAS Name: 4-[(E)-4-(5-but-1-en-2-yl-2-hydroxy-3,6-dihydrooxaborin-6-yl)-2-ethylbut-1-enyl]phenol IUPAC Name: 4-[(E)-4-(5-but-1-en-2-yl-2-hydroxy-3,6-dihydrooxaborinin-6-yl)-2-ethylbut-1-enyl]phenol Traditional Name: 4-[(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=C(C=C2)O)CC)C(=C)CC)O

Isomeric SMILES

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

InChI

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