4-[1,2-bis(bromanyl)-3-oxidanylidene-3-(2-phenylmethoxyphenyl)propyl]benzenecarbonitrile

Systemtic Name: 4-[1,2-bis(bromanyl)-3-oxidanylidene-3-(2-phenylmethoxyphenyl)propyl]benzenecarbonitrile Openeye Name: 4-[3-(2-benzyloxyphenyl)-1,2-dibromo-3-oxo-propyl]benzonitrile CAS Name: 4-[1,2-dibromo-3-oxo-3-(2-phenylmethoxyphenyl)propyl]benzonitrile IUPAC Name: 4-[1,2-dibromo-3-oxo-3-(2-phenylmethoxyphenyl)propyl]benzonitrile Traditional Name: 4-[3-(2-benzoxyphenyl)-1,2-dibromo-3-keto-propyl]benzonitrile Formula: C23H17Br2NO2 MolecularWeight: 499.19458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC=C2C(=O)C(C(C3=CC=C(C=C3)C#N)Br)Br

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC=C2C(=O)C(C(C3=CC=C(C=C3)C#N)Br)Br

InChI

InChI=1S/C23H17Br2NO2/c24-21(18-12-10-16(14-26)11-13-18)22(25)23(27)19-8-4-5-9-20(19)28-15-17-6-2-1-3-7-17/h1-13,21-22H,15H2