5-[4-[4-(4-pentylcyclohexyl)phenyl]phenyl]-2-propyl-1,3,2-oxazaborinane

Systemtic Name: 5-[4-[4-(4-pentylcyclohexyl)phenyl]phenyl]-2-propyl-1,3,2-oxazaborinane Openeye Name: 5-[4-[4-(4-pentylcyclohexyl)phenyl]phenyl]-2-propyl-1,3,2-oxazaborinane CAS Name: 5-[4-[4-(4-pentylcyclohexyl)phenyl]phenyl]-2-propyl-1,3,2-oxazaborinane IUPAC Name: 5-[4-[4-(4-pentylcyclohexyl)phenyl]phenyl]-2-propyl-1,3,2-oxazaborinane Traditional Name: 5-[4-[4-(4-amylcyclohexyl)phenyl]phenyl]-2-propyl-1,3,2-oxazaborinane Formula: C29H42BNO MolecularWeight: 431.46088

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Descriptors Computed from Structure

Canonical SMILES:

B1(NCC(CO1)C2=CC=C(C=C2)C3=CC=C(C=C3)C4CCC(CC4)CCCCC)CCC

Isomeric SMILES

B1(NCC(CO1)C2=CC=C(C=C2)C3=CC=C(C=C3)C4CCC(CC4)CCCCC)CCC

InChI

InChI=1S/C29H42BNO/c1-3-5-6-7-23-8-10-24(11-9-23)25-12-14-26(15-13-25)27-16-18-28(19-17-27)29-21-31-30(20-4-2)32-22-29/h12-19,23-24,29,31H,3-11,20-22H2,1-2H3