4-butyl-3-methyl-1-phenyl-3-prop-1-en-2-yl-2H-borole

Systemtic Name: 4-butyl-3-methyl-1-phenyl-3-prop-1-en-2-yl-2H-borole Openeye Name: 4-butyl-3-isopropenyl-3-methyl-1-phenyl-2H-borole CAS Name: 4-butyl-3-methyl-3-(1-methylethenyl)-1-phenyl-2H-borole IUPAC Name: 4-butyl-3-methyl-1-phenyl-3-prop-1-en-2-yl-2H-borole Traditional Name: 4-butyl-3-isopropenyl-3-methyl-1-phenyl-2H-borole Formula: C18H25B MolecularWeight: 252.2021

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Descriptors Computed from Structure

Canonical SMILES:

B1(CC(C(=C1)CCCC)(C)C(=C)C)C2=CC=CC=C2

Isomeric SMILES

B1(CC(C(=C1)CCCC)(C)C(=C)C)C2=CC=CC=C2

InChI

InChI=1S/C18H25B/c1-5-6-10-16-13-19(14-18(16,4)15(2)3)17-11-8-7-9-12-17/h7-9,11-13H,2,5-6,10,14H2,1,3-4H3