1-butyl-5-(5-methoxy-2-oxidanyl-phenyl)carbonyl-2-oxidanylidene-pyridine-3-carbonitrile

Systemtic Name: 1-butyl-5-(5-methoxy-2-oxidanyl-phenyl)carbonyl-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 1-butyl-5-(2-hydroxy-5-methoxy-benzoyl)-2-oxo-pyridine-3-carbonitrile CAS Name: 1-butyl-5-[(2-hydroxy-5-methoxyphenyl)-oxomethyl]-2-oxo-3-pyridinecarbonitrile IUPAC Name: 1-butyl-5-(2-hydroxy-5-methoxybenzoyl)-2-oxopyridine-3-carbonitrile Traditional Name: 1-butyl-5-(2-hydroxy-5-methoxy-benzoyl)-2-keto-nicotinonitrile Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(C=C(C1=O)C#N)C(=O)C2=C(C=CC(=C2)OC)O

Isomeric SMILES

CCCCN1C=C(C=C(C1=O)C#N)C(=O)C2=C(C=CC(=C2)OC)O

InChI

InChI=1S/C18H18N2O4/c1-3-4-7-20-11-13(8-12(10-19)18(20)23)17(22)15-9-14(24-2)5-6-16(15)21/h5-6,8-9,11,21H,3-4,7H2,1-2H3