5-(5-bromanyl-2-oxidanyl-phenyl)carbonyl-2-oxidanylidene-1-(2,4,6-trimethylphenyl)pyridine-3-carbonitrile

Systemtic Name: 5-(5-bromanyl-2-oxidanyl-phenyl)carbonyl-2-oxidanylidene-1-(2,4,6-trimethylphenyl)pyridine-3-carbonitrile Openeye Name: 5-(5-bromo-2-hydroxy-benzoyl)-2-oxo-1-(2,4,6-trimethylphenyl)pyridine-3-carbonitrile CAS Name: 5-[(5-bromo-2-hydroxyphenyl)-oxomethyl]-2-oxo-1-(2,4,6-trimethylphenyl)-3-pyridinecarbonitrile IUPAC Name: 5-(5-bromo-2-hydroxybenzoyl)-2-oxo-1-(2,4,6-trimethylphenyl)pyridine-3-carbonitrile Traditional Name: 5-(5-bromo-2-hydroxy-benzoyl)-2-keto-1-mesityl-nicotinonitrile Formula: C22H17BrN2O3 MolecularWeight: 437.28598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)N2C=C(C=C(C2=O)C#N)C(=O)C3=C(C=CC(=C3)Br)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)N2C=C(C=C(C2=O)C#N)C(=O)C3=C(C=CC(=C3)Br)O)C

InChI

InChI=1S/C22H17BrN2O3/c1-12-6-13(2)20(14(3)7-12)25-11-16(8-15(10-24)22(25)28)21(27)18-9-17(23)4-5-19(18)26/h4-9,11,26H,1-3H3