5-(5-chloranyl-2-oxidanyl-phenyl)carbonyl-1-(3-ethoxypropyl)-2-oxidanylidene-pyridine-3-carbonitrile

Systemtic Name: 5-(5-chloranyl-2-oxidanyl-phenyl)carbonyl-1-(3-ethoxypropyl)-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 5-(5-chloro-2-hydroxy-benzoyl)-1-(3-ethoxypropyl)-2-oxo-pyridine-3-carbonitrile CAS Name: 5-[(5-chloro-2-hydroxyphenyl)-oxomethyl]-1-(3-ethoxypropyl)-2-oxo-3-pyridinecarbonitrile IUPAC Name: 5-(5-chloro-2-hydroxybenzoyl)-1-(3-ethoxypropyl)-2-oxopyridine-3-carbonitrile Traditional Name: 5-(5-chloro-2-hydroxy-benzoyl)-1-(3-ethoxypropyl)-2-keto-nicotinonitrile Formula: C18H17ClN2O4 MolecularWeight: 360.79158

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C=C(C=C(C1=O)C#N)C(=O)C2=C(C=CC(=C2)Cl)O

Isomeric SMILES

CCOCCCN1C=C(C=C(C1=O)C#N)C(=O)C2=C(C=CC(=C2)Cl)O

InChI

InChI=1S/C18H17ClN2O4/c1-2-25-7-3-6-21-11-13(8-12(10-20)18(21)24)17(23)15-9-14(19)4-5-16(15)22/h4-5,8-9,11,22H,2-3,6-7H2,1H3