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

Systemtic Name: 6-(5-bromanyl-2-oxidanyl-phenyl)-2-oxidanylidene-4-phenethyl-1H-pyridine-3-carbonitrile Openeye Name: 6-(5-bromo-2-hydroxy-phenyl)-2-oxo-4-phenethyl-1H-pyridine-3-carbonitrile CAS Name: 6-(5-bromo-2-hydroxyphenyl)-2-oxo-4-phenethyl-1H-pyridine-3-carbonitrile IUPAC Name: 6-(5-bromo-2-hydroxyphenyl)-2-oxo-4-phenethyl-1H-pyridine-3-carbonitrile Traditional Name: 6-(5-bromo-2-hydroxy-phenyl)-2-keto-4-phenethyl-1H-pyridine-3-carbonitrile Formula: C20H15BrN2O2 MolecularWeight: 395.2493

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=C(C(=O)NC(=C2)C3=C(C=CC(=C3)Br)O)C#N

Isomeric SMILES

C1=CC=C(C=C1)CCC2=C(C(=O)NC(=C2)C3=C(C=CC(=C3)Br)O)C#N

InChI

InChI=1S/C20H15BrN2O2/c21-15-8-9-19(24)16(11-15)18-10-14(17(12-22)20(25)23-18)7-6-13-4-2-1-3-5-13/h1-5,8-11,24H,6-7H2,(H,23,25)