2-(3-bromophenyl)-3-oxidanylidene-3-(2,4,6-trimethylphenyl)propanenitrile

Systemtic Name: 2-(3-bromophenyl)-3-oxidanylidene-3-(2,4,6-trimethylphenyl)propanenitrile Openeye Name: 2-(3-bromophenyl)-3-oxo-3-(2,4,6-trimethylphenyl)propanenitrile CAS Name: 2-(3-bromophenyl)-3-oxo-3-(2,4,6-trimethylphenyl)propanenitrile IUPAC Name: 2-(3-bromophenyl)-3-oxo-3-(2,4,6-trimethylphenyl)propanenitrile Traditional Name: 2-(3-bromophenyl)-3-keto-3-mesityl-propionitrile Formula: C18H16BrNO MolecularWeight: 342.22974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)C(C#N)C2=CC(=CC=C2)Br)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)C(C#N)C2=CC(=CC=C2)Br)C

InChI

InChI=1S/C18H16BrNO/c1-11-7-12(2)17(13(3)8-11)18(21)16(10-20)14-5-4-6-15(19)9-14/h4-9,16H,1-3H3