3-[6-bromanyl-2,3-bis(phenylmethoxy)phenyl]propanenitrile

Systemtic Name: 3-[6-bromanyl-2,3-bis(phenylmethoxy)phenyl]propanenitrile Openeye Name: 3-(2,3-dibenzyloxy-6-bromo-phenyl)propanenitrile CAS Name: 3-[6-bromo-2,3-bis(phenylmethoxy)phenyl]propanenitrile IUPAC Name: 3-[6-bromo-2,3-bis(phenylmethoxy)phenyl]propanenitrile Traditional Name: 3-(2,3-dibenzoxy-6-bromo-phenyl)propionitrile Formula: C23H20BrNO2 MolecularWeight: 422.3144

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C(=C(C=C2)Br)CCC#N)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C(=C(C=C2)Br)CCC#N)OCC3=CC=CC=C3

InChI

InChI=1S/C23H20BrNO2/c24-21-13-14-22(26-16-18-8-3-1-4-9-18)23(20(21)12-7-15-25)27-17-19-10-5-2-6-11-19/h1-6,8-11,13-14H,7,12,16-17H2