4-chloranyl-2,5-bis(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzenecarbonitrile

Systemtic Name: 4-chloranyl-2,5-bis(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzenecarbonitrile Openeye Name: 4-chloro-2,5-bis(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzonitrile CAS Name: 4-chloro-2,5-bis(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzonitrile IUPAC Name: 4-chloro-2,5-bis(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzonitrile Traditional Name: 4-chloro-2,5-bis(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzonitrile Formula: C17H22B2ClNO4 MolecularWeight: 361.43588

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Descriptors Computed from Structure

Canonical SMILES:

B1(OCC(CO1)(C)C)C2=CC(=C(C=C2Cl)B3OCC(CO3)(C)C)C#N

Isomeric SMILES

B1(OCC(CO1)(C)C)C2=CC(=C(C=C2Cl)B3OCC(CO3)(C)C)C#N

InChI

InChI=1S/C17H22B2ClNO4/c1-16(2)8-22-18(23-9-16)13-6-15(20)14(5-12(13)7-21)19-24-10-17(3,4)11-25-19/h5-6H,8-11H2,1-4H3