3-imidazol-1-yl-2-methyl-propanenitrile; (2-methylphenyl)-(4-methylphenyl)-prop-2-enyl-borane

Systemtic Name: 3-imidazol-1-yl-2-methyl-propanenitrile; (2-methylphenyl)-(4-methylphenyl)-prop-2-enyl-borane Openeye Name: allyl-(o-tolyl)-(p-tolyl)borane; 3-imidazol-1-yl-2-methyl-propanenitrile CAS Name: 3-(1-imidazolyl)-2-methylpropanenitrile; (2-methylphenyl)-(4-methylphenyl)-prop-2-enylborane IUPAC Name: 3-imidazol-1-yl-2-methylpropanenitrile; (2-methylphenyl)-(4-methylphenyl)-prop-2-enylborane Traditional Name: allyl-(o-tolyl)-(p-tolyl)borane; 3-imidazol-1-yl-2-methyl-propionitrile Formula: C24H28BN3 MolecularWeight: 369.31022

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Descriptors Computed from Structure

Canonical SMILES:

B(CC=C)(C1=CC=C(C=C1)C)C2=CC=CC=C2C.CC(CN1C=CN=C1)C#N

Isomeric SMILES

B(CC=C)(C1=CC=C(C=C1)C)C2=CC=CC=C2C.CC(CN1C=CN=C1)C#N

InChI

InChI=1S/C17H19B.C7H9N3/c1-4-13-18(16-11-9-14(2)10-12-16)17-8-6-5-7-15(17)3;1-7(4-8)5-10-3-2-9-6-10/h4-12H,1,13H2,2-3H3;2-3,6-7H,5H2,1H3