4-(5-propyl-1,3,2-dioxaborinan-2-yl)benzenecarbonitrile

Systemtic Name: 4-(5-propyl-1,3,2-dioxaborinan-2-yl)benzenecarbonitrile Openeye Name: 4-(5-propyl-1,3,2-dioxaborinan-2-yl)benzonitrile CAS Name: 4-(5-propyl-1,3,2-dioxaborinan-2-yl)benzonitrile IUPAC Name: 4-(5-propyl-1,3,2-dioxaborinan-2-yl)benzonitrile Traditional Name: 4-(5-propyl-1,3,2-dioxaborinan-2-yl)benzonitrile Formula: C13H16BNO2 MolecularWeight: 229.08264

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Descriptors Computed from Structure

Canonical SMILES:

B1(OCC(CO1)CCC)C2=CC=C(C=C2)C#N

Isomeric SMILES

B1(OCC(CO1)CCC)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C13H16BNO2/c1-2-3-12-9-16-14(17-10-12)13-6-4-11(8-15)5-7-13/h4-7,12H,2-3,9-10H2,1H3