4-(3-bromophenyl)-2-ethanoyl-4-oxidanylidene-butanenitrile

Systemtic Name: 4-(3-bromophenyl)-2-ethanoyl-4-oxidanylidene-butanenitrile Openeye Name: 2-acetyl-4-(3-bromophenyl)-4-oxo-butanenitrile CAS Name: 2-acetyl-4-(3-bromophenyl)-4-oxobutanenitrile IUPAC Name: 2-acetyl-4-(3-bromophenyl)-4-oxobutanenitrile Traditional Name: 2-acetyl-4-(3-bromophenyl)-4-keto-butyronitrile Formula: C12H10BrNO2 MolecularWeight: 280.1173

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10BrNO2/c1-8(15)10(7-14)6-12(16)9-3-2-4-11(13)5-9/h2-5,10H,6H2,1H3