5-(5-chloranyl-2-oxidanyl-phenyl)carbonyl-1-(3,4-dimethoxyphenyl)-2-oxidanylidene-pyridine-3-carbonitrile

Systemtic Name: 5-(5-chloranyl-2-oxidanyl-phenyl)carbonyl-1-(3,4-dimethoxyphenyl)-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 5-(5-chloro-2-hydroxy-benzoyl)-1-(3,4-dimethoxyphenyl)-2-oxo-pyridine-3-carbonitrile CAS Name: 5-[(5-chloro-2-hydroxyphenyl)-oxomethyl]-1-(3,4-dimethoxyphenyl)-2-oxo-3-pyridinecarbonitrile IUPAC Name: 5-(5-chloro-2-hydroxybenzoyl)-1-(3,4-dimethoxyphenyl)-2-oxopyridine-3-carbonitrile Traditional Name: 5-(5-chloro-2-hydroxy-benzoyl)-1-(3,4-dimethoxyphenyl)-2-keto-nicotinonitrile Formula: C21H15ClN2O5 MolecularWeight: 410.8072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C=C(C=C(C2=O)C#N)C(=O)C3=C(C=CC(=C3)Cl)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N2C=C(C=C(C2=O)C#N)C(=O)C3=C(C=CC(=C3)Cl)O)OC

InChI

InChI=1S/C21H15ClN2O5/c1-28-18-6-4-15(9-19(18)29-2)24-11-13(7-12(10-23)21(24)27)20(26)16-8-14(22)3-5-17(16)25/h3-9,11,25H,1-2H3