5-(5-bromanyl-2-oxidanyl-phenyl)carbonyl-1-(2-methoxyphenyl)-2-oxidanylidene-pyridine-3-carbonitrile

Systemtic Name: 5-(5-bromanyl-2-oxidanyl-phenyl)carbonyl-1-(2-methoxyphenyl)-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 5-(5-bromo-2-hydroxy-benzoyl)-1-(2-methoxyphenyl)-2-oxo-pyridine-3-carbonitrile CAS Name: 5-[(5-bromo-2-hydroxyphenyl)-oxomethyl]-1-(2-methoxyphenyl)-2-oxo-3-pyridinecarbonitrile IUPAC Name: 5-(5-bromo-2-hydroxybenzoyl)-1-(2-methoxyphenyl)-2-oxopyridine-3-carbonitrile Traditional Name: 5-(5-bromo-2-hydroxy-benzoyl)-2-keto-1-(2-methoxyphenyl)nicotinonitrile Formula: C20H13BrN2O4 MolecularWeight: 425.23222

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C=C(C=C(C2=O)C#N)C(=O)C3=C(C=CC(=C3)Br)O

Isomeric SMILES

COC1=CC=CC=C1N2C=C(C=C(C2=O)C#N)C(=O)C3=C(C=CC(=C3)Br)O

InChI

InChI=1S/C20H13BrN2O4/c1-27-18-5-3-2-4-16(18)23-11-13(8-12(10-22)20(23)26)19(25)15-9-14(21)6-7-17(15)24/h2-9,11,24H,1H3