6-(5-bromanyl-2-oxidanyl-phenyl)-2-oxidanylidene-4-(1-phenylcyclopropyl)-1H-pyridine-3-carbonitrile

Systemtic Name: 6-(5-bromanyl-2-oxidanyl-phenyl)-2-oxidanylidene-4-(1-phenylcyclopropyl)-1H-pyridine-3-carbonitrile Openeye Name: 6-(5-bromo-2-hydroxy-phenyl)-2-oxo-4-(1-phenylcyclopropyl)-1H-pyridine-3-carbonitrile CAS Name: 6-(5-bromo-2-hydroxyphenyl)-2-oxo-4-(1-phenylcyclopropyl)-1H-pyridine-3-carbonitrile IUPAC Name: 6-(5-bromo-2-hydroxyphenyl)-2-oxo-4-(1-phenylcyclopropyl)-1H-pyridine-3-carbonitrile Traditional Name: 6-(5-bromo-2-hydroxy-phenyl)-2-keto-4-(1-phenylcyclopropyl)-1H-pyridine-3-carbonitrile Formula: C21H15BrN2O2 MolecularWeight: 407.26

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(C2=CC=CC=C2)C3=C(C(=O)NC(=C3)C4=C(C=CC(=C4)Br)O)C#N

Isomeric SMILES

C1CC1(C2=CC=CC=C2)C3=C(C(=O)NC(=C3)C4=C(C=CC(=C4)Br)O)C#N

InChI

InChI=1S/C21H15BrN2O2/c22-14-6-7-19(25)15(10-14)18-11-17(16(12-23)20(26)24-18)21(8-9-21)13-4-2-1-3-5-13/h1-7,10-11,25H,8-9H2,(H,24,26)